4,6-dimethyl-2-oxidanylidene-5-(pyrimidin-2-ylsulfanylmethyl)-1H-pyridine-3-carbonitrile

Systemtic Name: 4,6-dimethyl-2-oxidanylidene-5-(pyrimidin-2-ylsulfanylmethyl)-1H-pyridine-3-carbonitrile Openeye Name: 4,6-dimethyl-2-oxo-5-(pyrimidin-2-ylsulfanylmethyl)-1H-pyridine-3-carbonitrile CAS Name: 4,6-dimethyl-2-oxo-5-[(2-pyrimidinylthio)methyl]-1H-pyridine-3-carbonitrile IUPAC Name: 4,6-dimethyl-2-oxo-5-(pyrimidin-2-ylsulfanylmethyl)-1H-pyridine-3-carbonitrile Traditional Name: 2-keto-4,6-dimethyl-5-[(2-pyrimidylthio)methyl]-1H-pyridine-3-carbonitrile Formula: C13H12N4OS MolecularWeight: 272.32558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=C1CSC2=NC=CC=N2)C)C#N

Isomeric SMILES

CC1=C(C(=O)NC(=C1CSC2=NC=CC=N2)C)C#N

InChI

InChI=1S/C13H12N4OS/c1-8-10(6-14)12(18)17-9(2)11(8)7-19-13-15-4-3-5-16-13/h3-5H,7H2,1-2H3,(H,17,18)