2-[4-methyl-3-oxidanylidene-2,5-bis(phenylmethyl)piperazin-1-yl]-2-oxidanylidene-ethanenitrile

Systemtic Name: 2-[4-methyl-3-oxidanylidene-2,5-bis(phenylmethyl)piperazin-1-yl]-2-oxidanylidene-ethanenitrile Openeye Name: 2,5-dibenzyl-4-methyl-3-oxo-piperazine-1-carbonyl cyanide CAS Name: 2-[4-methyl-3-oxo-2,5-bis(phenylmethyl)-1-piperazinyl]-2-oxoacetonitrile IUPAC Name: 2,5-dibenzyl-4-methyl-3-oxopiperazine-1-carbonyl cyanide Traditional Name: 2-(2,5-dibenzyl-3-keto-4-methyl-piperazino)-2-keto-acetonitrile Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(CN(C(C1=O)CC2=CC=CC=C2)C(=O)C#N)CC3=CC=CC=C3

Isomeric SMILES

CN1C(CN(C(C1=O)CC2=CC=CC=C2)C(=O)C#N)CC3=CC=CC=C3

InChI

InChI=1S/C21H21N3O2/c1-23-18(12-16-8-4-2-5-9-16)15-24(20(25)14-22)19(21(23)26)13-17-10-6-3-7-11-17/h2-11,18-19H,12-13,15H2,1H3