4-methyl-2-[methyl(2-naphthalen-2-ylethanoyl)amino]-N-[3-oxidanylidene-1-(phenylsulfonyl)azepan-4-yl]pentanamide

Systemtic Name: 4-methyl-2-[methyl(2-naphthalen-2-ylethanoyl)amino]-N-[3-oxidanylidene-1-(phenylsulfonyl)azepan-4-yl]pentanamide Openeye Name: N-[1-(benzenesulfonyl)-3-oxo-azepan-4-yl]-4-methyl-2-[methyl-[2-(2-naphthyl)acetyl]amino]pentanamide CAS Name: N-[1-(benzenesulfonyl)-3-oxo-4-azepanyl]-4-methyl-2-[methyl-[2-(2-naphthalenyl)-1-oxoethyl]amino]pentanamide IUPAC Name: N-[1-(benzenesulfonyl)-3-oxoazepan-4-yl]-4-methyl-2-[methyl-(2-naphthalen-2-ylacetyl)amino]pentanamide Traditional Name: N-(1-besyl-3-keto-azepan-4-yl)-4-methyl-2-[methyl-[2-(2-naphthyl)acetyl]amino]valeramide Formula: C31H37N3O5S MolecularWeight: 563.70758

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1CCCN(CC1=O)S(=O)(=O)C2=CC=CC=C2)N(C)C(=O)CC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC(C)CC(C(=O)NC1CCCN(CC1=O)S(=O)(=O)C2=CC=CC=C2)N(C)C(=O)CC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C31H37N3O5S/c1-22(2)18-28(33(3)30(36)20-23-15-16-24-10-7-8-11-25(24)19-23)31(37)32-27-14-9-17-34(21-29(27)35)40(38,39)26-12-5-4-6-13-26/h4-8,10-13,15-16,19,22,27-28H,9,14,17-18,20-21H2,1-3H3,(H,32,37)