In the mol-ecule from the title compound C19H17NO3S the dihedral angle

In the mol-ecule from the title compound C19H17NO3S the dihedral angle formed with the quinoline band system as well as the thio-phene band is 83. framework find: Prasath (2011 ?). Experimental ? Crystal data ? C19H17NO3S = 339.40 Orthorhombic = 24.545 (8) ? = 8.689 (3) JNJ-26481585 ? = 15.809 (5) ? = 3371.5 (19) ?3 = 8 Mo = 293 K 0.25 × 0.23 × 0.2 mm Data collection ? Bruker Wise APEXII area-detector diffractometer Absorption modification: multi-scan (> 2σ(= 1.03 4152 reflections 219 variables H-atom variables constrained Δρmax = 0.23 e ??3 Δρmin = ?0.21 e ??3 Data collection: (Bruker 2008 ?); cell refinement: (Bruker 2008 ?); data decrease: (Sheldrick 2008 ?); plan(s) utilized to refine framework: (Sheldrick 2008 ?); molecular images: (Farrugia 1997 ?); software program used to get ready materials for publication: and (Spek 2009 ?). ? Desk 1 Hydrogen-bond geometry (? °) Supplementary Materials Crystal framework: includes datablock(s) global I. DOI: 10.1107/S1600536812014560/bt5861sup1.cif Just click here to see.(20K cif) Framework elements: contains datablock(s) I. DOI: 10.1107/S1600536812014560/bt5861Isup2.hkl Just click here to see.(199K hkl) Supplementary materials document. DOI: 10.1107/S1600536812014560/bt5861Isup3.cml Extra supplementary components: crystallographic details; 3D watch; checkCIF survey Acknowledgments SS and DV give thanks to the TBI X-ray Service CAS in Crystallography and Biophysics School of Madras India for KDM4A antibody the info collection as well as the School Grants Fee (UGC & SAP) for economic support. supplementary crystallographic details Comment The name compound like the JNJ-26481585 derivatives reported is available to exhibit extraordinary antibacterial activity (Anand axis (Fig. 2). The packing from the molecules is influenced by C-H···π interactions additional. Experimental Methyl (2= 339.40= 24.545 (8) ?θ = 1.7-28.3°= 8.689 (3) ?μ = 0.21 mm?1= 15.809 (5) ?= 293 K= 3371.5 (19) ?3Block colourless= 80.25 × 0.23 × 0.2 mm View it in a separate windows Data collection Bruker SMART APEXII area-detector diffractometer4152 indie reflectionsRadiation resource: fine-focus sealed tube2805 reflections with > 2σ(= ?32→32= ?11→917529 measured reflections= ?20→20 View it in a separate windows Refinement Refinement on = 1.03= 1/[σ2(= (and goodness of fit are based on are based on collection to zero for bad F2. The threshold manifestation of F2 > σ(F2) is used only for calculating R-factors(gt) etc. and is not relevant to the choice of reflections for refinement. R-factors based on F2 are statistically about twice as large as those JNJ-26481585 based on F and R– factors based on ALL data will become even larger. View it in a separate windows Fractional atomic coordinates and isotropic or comparative isotropic displacement guidelines (?2) xyzUiso*/UeqC10.66864 (5)0.24488 (16)0.06658 (11)0.0385 (4)C20.71433 (6)0.15068 (18)0.08567 (13)0.0498 (5)C30.74634 (7)0.1053 (2)0.01550 (16)0.0656 (6)H30.77700.04430.02400.079*C40.73280 (7)0.1497 (2)?0.06405 (16)0.0643 (6)H40.75410.1193?0.10980.077*C50.68630 (6)0.2421 (2)?0.07710 (12)0.0516 (4)C60.66978 (9)0.2936 (3)?0.16408 (14)0.0752 (6)H6A0.63150.2762?0.17170.113*H6B0.68980.2362?0.20560.113*H6C0.67750.4013?0.17050.113*C70.72541 (7)0.1091 (2)0.17010 (15)0.0628 (5)H70.75540.04750.18240.075*C80.69243 (7)0.1587 (2)0.23369 (14)0.0579 (5)H80.70010.13030.28910.070*C90.64683 (6)0.25249 (19)0.21687 (11)0.0471 (4)H90.62480.28580.26110.056*C100.63489 (6)0.29474 (17)0.13523 (11)0.0378 (4)C110.55580 (6)0.43432 (17)0.17728 (10)0.0385 (3)H11A0.57610.48780.22100.046*H11B0.53780.34640.20270.046*C120.51445 (6)0.54034 (17)0.13842 (10)0.0383 (3)C130.46895 (6)0.49681 (18)0.09823 (10)0.0396 (4)H130.44840.57810.07710.048*C140.44592 (6)0.34661 (17)0.08167 (11)0.0415 (4)C150.39555 (7)0.32582 (19)0.04619 (13)0.0517 (4)H150.37330.40660.02900.062*C160.38082 (8)0.1701 (2)0.03840 (15)0.0622 (5)H160.34770.13720.01620.075*C170.41989 (7)0.0735 JNJ-26481585 (2)0.06666 (13)0.0604 (5)H170.4169?0.03320.06600.072*C180.52379 (6)0.70908 (19)0.14450 (12)0.0453 (4)C190.58520 (9)0.9061 (2)0.18099 (16)0.0772 (7)H19A0.57520.95860.12990.116*H19B0.62340.91990.19140.116*H19C0.56480.94750.22750.116*N10.65531 (5)0.28865 (15)?0.01364 (9)0.0434 (3)O10.59204 (4)0.38425 (13)0.11118 (7)0.0437 (3)O20.57341 (5)0.74353 (13)0.17233 (9)0.0614 (4)O30.49055 (6)0.80581 (14)0.12741 (11)0.0718 (5)S10.475215 (18)0.16968 (5)0.10362 (3)0.05398 (16) View it in a separate window Atomic.