3-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]pentanenitrile

Systemtic Name: 3-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]pentanenitrile Openeye Name: 3-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]pentanenitrile CAS Name: 3-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)thio]pentanenitrile IUPAC Name: 3-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]pentanenitrile Traditional Name: 3-[(4-keto-6-methyl-1H-pyrimidin-2-yl)thio]valeronitrile Formula: C10H13N3OS MolecularWeight: 223.29472

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC#N)SC1=NC(=O)C=C(N1)C

Isomeric SMILES

CCC(CC#N)SC1=NC(=O)C=C(N1)C

InChI

InChI=1S/C10H13N3OS/c1-3-8(4-5-11)15-10-12-7(2)6-9(14)13-10/h6,8H,3-4H2,1-2H3,(H,12,13,14)