3-acetamido-N-[4-(azepan-1-ylsulfonyl)phenyl]-3-(4-methylphenyl)propanamide

Systemtic Name: 3-acetamido-N-[4-(azepan-1-ylsulfonyl)phenyl]-3-(4-methylphenyl)propanamide Openeye Name: 3-acetamido-N-[4-(azepan-1-ylsulfonyl)phenyl]-3-(p-tolyl)propanamide CAS Name: 3-acetamido-N-[4-(1-azepanylsulfonyl)phenyl]-3-(4-methylphenyl)propanamide IUPAC Name: 3-acetamido-N-[4-(azepan-1-ylsulfonyl)phenyl]-3-(4-methylphenyl)propanamide Traditional Name: 3-acetamido-N-[4-(azepan-1-ylsulfonyl)phenyl]-3-(p-tolyl)propionamide Formula: C24H31N3O4S MolecularWeight: 457.58564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C(CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)NC(=O)C

InChI

InChI=1S/C24H31N3O4S/c1-18-7-9-20(10-8-18)23(25-19(2)28)17-24(29)26-21-11-13-22(14-12-21)32(30,31)27-15-5-3-4-6-16-27/h7-14,23H,3-6,15-17H2,1-2H3,(H,25,28)(H,26,29)