6-methyl-4-oxidanylidene-1-(phenylmethyl)pyrimidine-5-carbonitrile

Systemtic Name: 6-methyl-4-oxidanylidene-1-(phenylmethyl)pyrimidine-5-carbonitrile Openeye Name: 1-benzyl-6-methyl-4-oxo-pyrimidine-5-carbonitrile CAS Name: 6-methyl-4-oxo-1-(phenylmethyl)-5-pyrimidinecarbonitrile IUPAC Name: 1-benzyl-6-methyl-4-oxopyrimidine-5-carbonitrile Traditional Name: 1-benzyl-4-keto-6-methyl-pyrimidine-5-carbonitrile Formula: C13H11N3O MolecularWeight: 225.24594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=CN1CC2=CC=CC=C2)C#N

Isomeric SMILES

CC1=C(C(=O)N=CN1CC2=CC=CC=C2)C#N

InChI

InChI=1S/C13H11N3O/c1-10-12(7-14)13(17)15-9-16(10)8-11-5-3-2-4-6-11/h2-6,9H,8H2,1H3