4-(4-chlorophenyl)carbonyl-N-(4-propan-2-ylphenyl)-1,4-diazepane-1-carboxamide

Systemtic Name: 4-(4-chlorophenyl)carbonyl-N-(4-propan-2-ylphenyl)-1,4-diazepane-1-carboxamide Openeye Name: 4-(4-chlorobenzoyl)-N-(4-isopropylphenyl)-1,4-diazepane-1-carboxamide CAS Name: 4-[(4-chlorophenyl)-oxomethyl]-N-(4-propan-2-ylphenyl)-1,4-diazepane-1-carboxamide IUPAC Name: 4-(4-chlorobenzoyl)-N-(4-propan-2-ylphenyl)-1,4-diazepane-1-carboxamide Traditional Name: 4-(4-chlorobenzoyl)-N-p-cumenyl-1,4-diazepane-1-carboxamide Formula: C22H26ClN3O2 MolecularWeight: 399.91374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)N2CCCN(CC2)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)N2CCCN(CC2)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H26ClN3O2/c1-16(2)17-6-10-20(11-7-17)24-22(28)26-13-3-12-25(14-15-26)21(27)18-4-8-19(23)9-5-18/h4-11,16H,3,12-15H2,1-2H3,(H,24,28)