1-methylsulfonyl-N-[2-(phenethylcarbamoyl)phenyl]-3,4-dihydro-2H-quinoline-6-carboxamide

Systemtic Name: 1-methylsulfonyl-N-[2-(phenethylcarbamoyl)phenyl]-3,4-dihydro-2H-quinoline-6-carboxamide Openeye Name: 1-methylsulfonyl-N-[2-(phenethylcarbamoyl)phenyl]-3,4-dihydro-2H-quinoline-6-carboxamide CAS Name: 1-methylsulfonyl-N-[2-[oxo-(phenethylamino)methyl]phenyl]-3,4-dihydro-2H-quinoline-6-carboxamide IUPAC Name: 1-methylsulfonyl-N-[2-(phenethylcarbamoyl)phenyl]-3,4-dihydro-2H-quinoline-6-carboxamide Traditional Name: 1-mesyl-N-[2-(phenethylcarbamoyl)phenyl]-3,4-dihydro-2H-quinoline-6-carboxamide Formula: C26H27N3O4S MolecularWeight: 477.57528

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCC2=C1C=CC(=C2)C(=O)NC3=CC=CC=C3C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)N1CCCC2=C1C=CC(=C2)C(=O)NC3=CC=CC=C3C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C26H27N3O4S/c1-34(32,33)29-17-7-10-20-18-21(13-14-24(20)29)25(30)28-23-12-6-5-11-22(23)26(31)27-16-15-19-8-3-2-4-9-19/h2-6,8-9,11-14,18H,7,10,15-17H2,1H3,(H,27,31)(H,28,30)