1-[1-(2,5-dimethylphenyl)-6-methyl-4-methylsulfanyl-2-sulfanylidene-pyrimidin-5-yl]ethanone

Systemtic Name: 1-[1-(2,5-dimethylphenyl)-6-methyl-4-methylsulfanyl-2-sulfanylidene-pyrimidin-5-yl]ethanone Openeye Name: 1-[1-(2,5-dimethylphenyl)-6-methyl-4-methylsulfanyl-2-thioxo-pyrimidin-5-yl]ethanone CAS Name: 1-[1-(2,5-dimethylphenyl)-6-methyl-4-(methylthio)-2-sulfanylidene-5-pyrimidinyl]ethanone IUPAC Name: 1-[1-(2,5-dimethylphenyl)-6-methyl-4-methylsulfanyl-2-sulfanylidenepyrimidin-5-yl]ethanone Traditional Name: 1-[1-(2,5-dimethylphenyl)-6-methyl-4-(methylthio)-2-thioxo-pyrimidin-5-yl]ethanone Formula: C16H18N2OS2 MolecularWeight: 318.45692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=C(C(=NC2=S)SC)C(=O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=C(C(=NC2=S)SC)C(=O)C)C

InChI

InChI=1S/C16H18N2OS2/c1-9-6-7-10(2)13(8-9)18-11(3)14(12(4)19)15(21-5)17-16(18)20/h6-8H,1-5H3