N-tert-butyl-2-[(3R,5S,7R)-3-[(3-methylphenyl)carbamoylamino]-2-oxidanylidene-5,7-diphenyl-azepan-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[(3R,5S,7R)-3-[(3-methylphenyl)carbamoylamino]-2-oxidanylidene-5,7-diphenyl-azepan-1-yl]ethanamide Openeye Name: N-tert-butyl-2-[(3R,5S,7R)-3-(m-tolylcarbamoylamino)-2-oxo-5,7-diphenyl-azepan-1-yl]acetamide CAS Name: N-tert-butyl-2-[(3R,5S,7R)-3-[[(3-methylanilino)-oxomethyl]amino]-2-oxo-5,7-diphenyl-1-azepanyl]acetamide IUPAC Name: N-tert-butyl-2-[(3R,5S,7R)-3-[(3-methylphenyl)carbamoylamino]-2-oxo-5,7-diphenylazepan-1-yl]acetamide Traditional Name: N-tert-butyl-2-[(3R,5S,7R)-2-keto-3-(m-tolylcarbamoylamino)-5,7-diphenyl-azepan-1-yl]acetamide Formula: C32H38N4O3 MolecularWeight: 526.66912

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)N[C@@H]2C[C@@H](C[C@@H](N(C2=O)CC(=O)NC(C)(C)C)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C32H38N4O3/c1-22-12-11-17-26(18-22)33-31(39)34-27-19-25(23-13-7-5-8-14-23)20-28(24-15-9-6-10-16-24)36(30(27)38)21-29(37)35-32(2,3)4/h5-18,25,27-28H,19-21H2,1-4H3,(H,35,37)(H2,33,34,39)/t25-,27+,28+/m0/s1