methyl 2-(3,5-dimethylphenyl)-6-methyl-4-sulfanylidene-1H-pyrimidine-5-carboxylate

Systemtic Name: methyl 2-(3,5-dimethylphenyl)-6-methyl-4-sulfanylidene-1H-pyrimidine-5-carboxylate Openeye Name: methyl 2-(3,5-dimethylphenyl)-6-methyl-4-thioxo-1H-pyrimidine-5-carboxylate CAS Name: 2-(3,5-dimethylphenyl)-6-methyl-4-sulfanylidene-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 2-(3,5-dimethylphenyl)-6-methyl-4-sulfanylidene-1H-pyrimidine-5-carboxylate Traditional Name: 2-(3,5-dimethylphenyl)-6-methyl-4-thioxo-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C15H16N2O2S MolecularWeight: 288.36474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=NC(=S)C(=C(N2)C)C(=O)OC)C

Isomeric SMILES

CC1=CC(=CC(=C1)C2=NC(=S)C(=C(N2)C)C(=O)OC)C

InChI

InChI=1S/C15H16N2O2S/c1-8-5-9(2)7-11(6-8)13-16-10(3)12(14(20)17-13)15(18)19-4/h5-7H,1-4H3,(H,16,17,20)