4-[[(5-methyl-6-oxidanylidene-1H-pyrimidin-2-yl)amino]methyl]benzenecarbonitrile

Systemtic Name: 4-[[(5-methyl-6-oxidanylidene-1H-pyrimidin-2-yl)amino]methyl]benzenecarbonitrile Openeye Name: 4-[[(5-methyl-6-oxo-1H-pyrimidin-2-yl)amino]methyl]benzonitrile CAS Name: 4-[[(5-methyl-6-oxo-1H-pyrimidin-2-yl)amino]methyl]benzonitrile IUPAC Name: 4-[[(5-methyl-6-oxo-1H-pyrimidin-2-yl)amino]methyl]benzonitrile Traditional Name: 4-[[(6-keto-5-methyl-1H-pyrimidin-2-yl)amino]methyl]benzonitrile Formula: C13H12N4O MolecularWeight: 240.26058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(NC1=O)NCC2=CC=C(C=C2)C#N

Isomeric SMILES

CC1=CN=C(NC1=O)NCC2=CC=C(C=C2)C#N

InChI

InChI=1S/C13H12N4O/c1-9-7-15-13(17-12(9)18)16-8-11-4-2-10(6-14)3-5-11/h2-5,7H,8H2,1H3,(H2,15,16,17,18)