N-(3-methylphenyl)-2-[2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethanoylamino]benzamide

Systemtic Name: N-(3-methylphenyl)-2-[2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethanoylamino]benzamide Openeye Name: 2-[[2-(4-benzyl-1,4-diazepan-1-yl)acetyl]amino]-N-(m-tolyl)benzamide CAS Name: N-(3-methylphenyl)-2-[[1-oxo-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethyl]amino]benzamide IUPAC Name: 2-[[2-(4-benzyl-1,4-diazepan-1-yl)acetyl]amino]-N-(3-methylphenyl)benzamide Traditional Name: 2-[[2-(4-benzyl-1,4-diazepan-1-yl)acetyl]amino]-N-(m-tolyl)benzamide Formula: C28H32N4O2 MolecularWeight: 456.57928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)CN3CCCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)CN3CCCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C28H32N4O2/c1-22-9-7-12-24(19-22)29-28(34)25-13-5-6-14-26(25)30-27(33)21-32-16-8-15-31(17-18-32)20-23-10-3-2-4-11-23/h2-7,9-14,19H,8,15-18,20-21H2,1H3,(H,29,34)(H,30,33)