4-(2-methylphenyl)carbonyl-N-(phenylmethyl)-1,4-diazepane-1-carboxamide

Systemtic Name: 4-(2-methylphenyl)carbonyl-N-(phenylmethyl)-1,4-diazepane-1-carboxamide Openeye Name: N-benzyl-4-(2-methylbenzoyl)-1,4-diazepane-1-carboxamide CAS Name: 4-[(2-methylphenyl)-oxomethyl]-N-(phenylmethyl)-1,4-diazepane-1-carboxamide IUPAC Name: N-benzyl-4-(2-methylbenzoyl)-1,4-diazepane-1-carboxamide Traditional Name: N-benzyl-4-o-toluoyl-1,4-diazepane-1-carboxamide Formula: C21H25N3O2 MolecularWeight: 351.4421

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCCN(CC2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCCN(CC2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C21H25N3O2/c1-17-8-5-6-11-19(17)20(25)23-12-7-13-24(15-14-23)21(26)22-16-18-9-3-2-4-10-18/h2-6,8-11H,7,12-16H2,1H3,(H,22,26)