N-[3-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-3-oxidanylidene-propyl]-2-phenyl-ethanamide

Systemtic Name: N-[3-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-3-oxidanylidene-propyl]-2-phenyl-ethanamide Openeye Name: N-[3-oxo-3-[4-(p-tolylmethyl)-1,4-diazepan-1-yl]propyl]-2-phenyl-acetamide CAS Name: N-[3-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-3-oxopropyl]-2-phenylacetamide IUPAC Name: N-[3-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-3-oxopropyl]-2-phenylacetamide Traditional Name: N-[3-keto-3-[4-(4-methylbenzyl)-1,4-diazepan-1-yl]propyl]-2-phenyl-acetamide Formula: C24H31N3O2 MolecularWeight: 393.52184

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H31N3O2/c1-20-8-10-22(11-9-20)19-26-14-5-15-27(17-16-26)24(29)12-13-25-23(28)18-21-6-3-2-4-7-21/h2-4,6-11H,5,12-19H2,1H3,(H,25,28)