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

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

Systemtic Name:4-[(5-ethanoyl-6-methyl-2-oxidanylidene-1H-pyrimidin-4-yl)sulfanylmethyl]benzenecarbonitrile
Openeye Name:4-[(5-acetyl-6-methyl-2-oxo-1H-pyrimidin-4-yl)sulfanylmethyl]benzonitrile
CAS Name:4-[[(5-acetyl-6-methyl-2-oxo-1H-pyrimidin-4-yl)thio]methyl]benzonitrile
IUPAC Name:4-[(5-acetyl-6-methyl-2-oxo-1H-pyrimidin-4-yl)sulfanylmethyl]benzonitrile
Traditional Name:4-[[(5-acetyl-2-keto-6-methyl-1H-pyrimidin-4-yl)thio]methyl]benzonitrile
Formula: C15H13N3O2S
MolecularWeight: 299.34762
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C15H13N3O2S/c1-9-13(10(2)19)14(18-15(20)17-9)21-8-12-5-3-11(7-16)4-6-12/h3-6H,8H2,1-2H3,(H,17,18,20)


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