N-[(3,4-dimethylphenyl)carbamoyl]-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethanamide

Systemtic Name: N-[(3,4-dimethylphenyl)carbamoyl]-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethanamide Openeye Name: 2-(4-benzyl-1,4-diazepan-1-yl)-N-[(3,4-dimethylphenyl)carbamoyl]acetamide CAS Name: N-[(3,4-dimethylanilino)-oxomethyl]-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]acetamide IUPAC Name: 2-(4-benzyl-1,4-diazepan-1-yl)-N-[(3,4-dimethylphenyl)carbamoyl]acetamide Traditional Name: 2-(4-benzyl-1,4-diazepan-1-yl)-N-[(3,4-dimethylphenyl)carbamoyl]acetamide Formula: C23H30N4O2 MolecularWeight: 394.5099

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NC(=O)CN2CCCN(CC2)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NC(=O)CN2CCCN(CC2)CC3=CC=CC=C3)C

InChI

InChI=1S/C23H30N4O2/c1-18-9-10-21(15-19(18)2)24-23(29)25-22(28)17-27-12-6-11-26(13-14-27)16-20-7-4-3-5-8-20/h3-5,7-10,15H,6,11-14,16-17H2,1-2H3,(H2,24,25,28,29)