N-[1-(4-methylphenyl)-3-oxidanylidene-3-[4-(phenylmethyl)-1,4-diazepan-1-yl]propyl]ethanamide

Systemtic Name: N-[1-(4-methylphenyl)-3-oxidanylidene-3-[4-(phenylmethyl)-1,4-diazepan-1-yl]propyl]ethanamide Openeye Name: N-[3-(4-benzyl-1,4-diazepan-1-yl)-3-oxo-1-(p-tolyl)propyl]acetamide CAS Name: N-[1-(4-methylphenyl)-3-oxo-3-[4-(phenylmethyl)-1,4-diazepan-1-yl]propyl]acetamide IUPAC Name: N-[3-(4-benzyl-1,4-diazepan-1-yl)-1-(4-methylphenyl)-3-oxopropyl]acetamide Traditional Name: N-[3-(4-benzyl-1,4-diazepan-1-yl)-3-keto-1-(p-tolyl)propyl]acetamide Formula: C24H31N3O2 MolecularWeight: 393.52184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CC(=O)N2CCCN(CC2)CC3=CC=CC=C3)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C(CC(=O)N2CCCN(CC2)CC3=CC=CC=C3)NC(=O)C

InChI

InChI=1S/C24H31N3O2/c1-19-9-11-22(12-10-19)23(25-20(2)28)17-24(29)27-14-6-13-26(15-16-27)18-21-7-4-3-5-8-21/h3-5,7-12,23H,6,13-18H2,1-2H3,(H,25,28)