N-[2-[4-[(4-cyanophenyl)methyl]-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl]-4-ethoxy-benzamide

Systemtic Name: N-[2-[4-[(4-cyanophenyl)methyl]-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl]-4-ethoxy-benzamide Openeye Name: N-[2-[4-[(4-cyanophenyl)methyl]-1,4-diazepan-1-yl]-2-oxo-ethyl]-4-ethoxy-benzamide CAS Name: N-[2-[4-[(4-cyanophenyl)methyl]-1,4-diazepan-1-yl]-2-oxoethyl]-4-ethoxybenzamide IUPAC Name: N-[2-[4-[(4-cyanophenyl)methyl]-1,4-diazepan-1-yl]-2-oxoethyl]-4-ethoxybenzamide Traditional Name: N-[2-[4-(4-cyanobenzyl)-1,4-diazepan-1-yl]-2-keto-ethyl]-4-ethoxy-benzamide Formula: C24H28N4O3 MolecularWeight: 420.50412

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NCC(=O)N2CCCN(CC2)CC3=CC=C(C=C3)C#N

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NCC(=O)N2CCCN(CC2)CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C24H28N4O3/c1-2-31-22-10-8-21(9-11-22)24(30)26-17-23(29)28-13-3-12-27(14-15-28)18-20-6-4-19(16-25)5-7-20/h4-11H,2-3,12-15,17-18H2,1H3,(H,26,30)