N-tert-butyl-N-[7-(4-chlorophenyl)-3-[(3-methylphenyl)carbamoylamino]-2-oxidanylidene-5-phenyl-azepan-1-yl]ethanamide

Systemtic Name: N-tert-butyl-N-[7-(4-chlorophenyl)-3-[(3-methylphenyl)carbamoylamino]-2-oxidanylidene-5-phenyl-azepan-1-yl]ethanamide Openeye Name: N-tert-butyl-N-[7-(4-chlorophenyl)-3-(m-tolylcarbamoylamino)-2-oxo-5-phenyl-azepan-1-yl]acetamide CAS Name: N-tert-butyl-N-[7-(4-chlorophenyl)-3-[[(3-methylanilino)-oxomethyl]amino]-2-oxo-5-phenyl-1-azepanyl]acetamide IUPAC Name: N-tert-butyl-N-[7-(4-chlorophenyl)-3-[(3-methylphenyl)carbamoylamino]-2-oxo-5-phenylazepan-1-yl]acetamide Traditional Name: N-tert-butyl-N-[7-(4-chlorophenyl)-2-keto-3-(m-tolylcarbamoylamino)-5-phenyl-azepan-1-yl]acetamide Formula: C32H37ClN4O3 MolecularWeight: 561.11418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NC2CC(CC(N(C2=O)N(C(=O)C)C(C)(C)C)C3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NC2CC(CC(N(C2=O)N(C(=O)C)C(C)(C)C)C3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C32H37ClN4O3/c1-21-10-9-13-27(18-21)34-31(40)35-28-19-25(23-11-7-6-8-12-23)20-29(24-14-16-26(33)17-15-24)36(30(28)39)37(22(2)38)32(3,4)5/h6-18,25,28-29H,19-20H2,1-5H3,(H2,34,35,40)