4-[2-[(2-chlorophenyl)amino]-2-oxidanylidene-ethyl]-N-(2-phenylphenyl)-1,4-diazepane-1-carboxamide

Systemtic Name: 4-[2-[(2-chlorophenyl)amino]-2-oxidanylidene-ethyl]-N-(2-phenylphenyl)-1,4-diazepane-1-carboxamide Openeye Name: 4-[2-(2-chloroanilino)-2-oxo-ethyl]-N-(2-phenylphenyl)-1,4-diazepane-1-carboxamide CAS Name: 4-[2-(2-chloroanilino)-2-oxoethyl]-N-(2-phenylphenyl)-1,4-diazepane-1-carboxamide IUPAC Name: 4-[2-(2-chloroanilino)-2-oxoethyl]-N-(2-phenylphenyl)-1,4-diazepane-1-carboxamide Traditional Name: 4-[2-(2-chloroanilino)-2-keto-ethyl]-N-(2-phenylphenyl)-1,4-diazepane-1-carboxamide Formula: C26H27ClN4O2 MolecularWeight: 462.97118

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)NC2=CC=CC=C2C3=CC=CC=C3)CC(=O)NC4=CC=CC=C4Cl

Isomeric SMILES

C1CN(CCN(C1)C(=O)NC2=CC=CC=C2C3=CC=CC=C3)CC(=O)NC4=CC=CC=C4Cl

InChI

InChI=1S/C26H27ClN4O2/c27-22-12-5-7-14-24(22)28-25(32)19-30-15-8-16-31(18-17-30)26(33)29-23-13-6-4-11-21(23)20-9-2-1-3-10-20/h1-7,9-14H,8,15-19H2,(H,28,32)(H,29,33)