6-methyl-4-oxidanylidene-2-(pyridin-3-ylmethylsulfanyl)-1H-pyrimidine-5-carbonitrile

Systemtic Name: 6-methyl-4-oxidanylidene-2-(pyridin-3-ylmethylsulfanyl)-1H-pyrimidine-5-carbonitrile Openeye Name: 6-methyl-4-oxo-2-(3-pyridylmethylsulfanyl)-1H-pyrimidine-5-carbonitrile CAS Name: 6-methyl-4-oxo-2-(3-pyridinylmethylthio)-1H-pyrimidine-5-carbonitrile IUPAC Name: 6-methyl-4-oxo-2-(pyridin-3-ylmethylsulfanyl)-1H-pyrimidine-5-carbonitrile Traditional Name: 4-keto-6-methyl-2-(3-pyridylmethylthio)-1H-pyrimidine-5-carbonitrile Formula: C12H10N4OS MolecularWeight: 258.299

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC2=CN=CC=C2)C#N

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC2=CN=CC=C2)C#N

InChI

InChI=1S/C12H10N4OS/c1-8-10(5-13)11(17)16-12(15-8)18-7-9-3-2-4-14-6-9/h2-4,6H,7H2,1H3,(H,15,16,17)