2-[[3,6-dimethyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 2-[[3,6-dimethyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]methyl]benzenecarbonitrile Openeye Name: 2-[(3,6-dimethyl-2,4-dioxo-pyrimidin-1-yl)methyl]benzonitrile CAS Name: 2-[(3,6-dimethyl-2,4-dioxo-1-pyrimidinyl)methyl]benzonitrile IUPAC Name: 2-[(3,6-dimethyl-2,4-dioxopyrimidin-1-yl)methyl]benzonitrile Traditional Name: 2-[(2,4-diketo-3,6-dimethyl-pyrimidin-1-yl)methyl]benzonitrile Formula: C14H13N3O2 MolecularWeight: 255.27192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=O)N1CC2=CC=CC=C2C#N)C

Isomeric SMILES

CC1=CC(=O)N(C(=O)N1CC2=CC=CC=C2C#N)C

InChI

InChI=1S/C14H13N3O2/c1-10-7-13(18)16(2)14(19)17(10)9-12-6-4-3-5-11(12)8-15/h3-7H,9H2,1-2H3