N-[(2-chlorophenyl)methyl]-4-(2-methylphenyl)carbonyl-1,4-diazepane-1-carboxamide

Systemtic Name: N-[(2-chlorophenyl)methyl]-4-(2-methylphenyl)carbonyl-1,4-diazepane-1-carboxamide Openeye Name: N-[(2-chlorophenyl)methyl]-4-(2-methylbenzoyl)-1,4-diazepane-1-carboxamide CAS Name: N-[(2-chlorophenyl)methyl]-4-[(2-methylphenyl)-oxomethyl]-1,4-diazepane-1-carboxamide IUPAC Name: N-[(2-chlorophenyl)methyl]-4-(2-methylbenzoyl)-1,4-diazepane-1-carboxamide Traditional Name: N-(2-chlorobenzyl)-4-o-toluoyl-1,4-diazepane-1-carboxamide Formula: C21H24ClN3O2 MolecularWeight: 385.88716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCCN(CC2)C(=O)NCC3=CC=CC=C3Cl

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCCN(CC2)C(=O)NCC3=CC=CC=C3Cl

InChI

InChI=1S/C21H24ClN3O2/c1-16-7-2-4-9-18(16)20(26)24-11-6-12-25(14-13-24)21(27)23-15-17-8-3-5-10-19(17)22/h2-5,7-10H,6,11-15H2,1H3,(H,23,27)