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

Systemtic Name: 2-[[2,4-bis(oxidanylidene)-1,3-bis(phenylmethyl)pyrimidin-5-yl]methyl]benzenecarbonitrile Openeye Name: 2-[(1,3-dibenzyl-2,4-dioxo-pyrimidin-5-yl)methyl]benzonitrile CAS Name: 2-[[2,4-dioxo-1,3-bis(phenylmethyl)-5-pyrimidinyl]methyl]benzonitrile IUPAC Name: 2-[(1,3-dibenzyl-2,4-dioxopyrimidin-5-yl)methyl]benzonitrile Traditional Name: 2-[(1,3-dibenzyl-2,4-diketo-pyrimidin-5-yl)methyl]benzonitrile Formula: C26H21N3O2 MolecularWeight: 407.46384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C(=O)N(C2=O)CC3=CC=CC=C3)CC4=CC=CC=C4C#N

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C(=O)N(C2=O)CC3=CC=CC=C3)CC4=CC=CC=C4C#N

InChI

InChI=1S/C26H21N3O2/c27-16-23-14-8-7-13-22(23)15-24-19-28(17-20-9-3-1-4-10-20)26(31)29(25(24)30)18-21-11-5-2-6-12-21/h1-14,19H,15,17-18H2