6-(azepan-1-ylsulfonyl)-N-[(2-chlorophenyl)methyl]-2-oxidanylidene-1H-quinoline-4-carboxamide

Systemtic Name: 6-(azepan-1-ylsulfonyl)-N-[(2-chlorophenyl)methyl]-2-oxidanylidene-1H-quinoline-4-carboxamide Openeye Name: 6-(azepan-1-ylsulfonyl)-N-[(2-chlorophenyl)methyl]-2-oxo-1H-quinoline-4-carboxamide CAS Name: 6-(1-azepanylsulfonyl)-N-[(2-chlorophenyl)methyl]-2-oxo-1H-quinoline-4-carboxamide IUPAC Name: 6-(azepan-1-ylsulfonyl)-N-[(2-chlorophenyl)methyl]-2-oxo-1H-quinoline-4-carboxamide Traditional Name: 6-(azepan-1-ylsulfonyl)-N-(2-chlorobenzyl)-2-keto-1H-quinoline-4-carboxamide Formula: C23H24ClN3O4S MolecularWeight: 473.97236

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)NC(=O)C=C3C(=O)NCC4=CC=CC=C4Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)NC(=O)C=C3C(=O)NCC4=CC=CC=C4Cl

InChI

InChI=1S/C23H24ClN3O4S/c24-20-8-4-3-7-16(20)15-25-23(29)19-14-22(28)26-21-10-9-17(13-18(19)21)32(30,31)27-11-5-1-2-6-12-27/h3-4,7-10,13-14H,1-2,5-6,11-12,15H2,(H,25,29)(H,26,28)