N-butan-2-yl-N-[2-[4-(2-methylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxidanylidene-ethyl]-3-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-butan-2-yl-N-[2-[4-(2-methylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxidanylidene-ethyl]-3-(trifluoromethyl)benzenesulfonamide Openeye Name: N-[2-[4-(o-tolyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxo-ethyl]-N-sec-butyl-3-(trifluoromethyl)benzenesulfonamide CAS Name: N-butan-2-yl-N-[2-[4-(2-methylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-3-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-butan-2-yl-N-[2-[4-(2-methylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-3-(trifluoromethyl)benzenesulfonamide Traditional Name: N-[2-keto-2-[4-(o-tolyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]ethyl]-N-sec-butyl-3-(trifluoromethyl)benzenesulfonamide Formula: C27H29F3N2O3S2 MolecularWeight: 550.65597

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC(=O)N1CCC2=C(C1C3=CC=CC=C3C)C=CS2)S(=O)(=O)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

CCC(C)N(CC(=O)N1CCC2=C(C1C3=CC=CC=C3C)C=CS2)S(=O)(=O)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C27H29F3N2O3S2/c1-4-19(3)32(37(34,35)21-10-7-9-20(16-21)27(28,29)30)17-25(33)31-14-12-24-23(13-15-36-24)26(31)22-11-6-5-8-18(22)2/h5-11,13,15-16,19,26H,4,12,14,17H2,1-3H3