methyl (6R)-3-(3,5-dimethylphenyl)-4-methyl-6-(1-methylpyrazol-4-yl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl (6R)-3-(3,5-dimethylphenyl)-4-methyl-6-(1-methylpyrazol-4-yl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl (6R)-3-(3,5-dimethylphenyl)-4-methyl-6-(1-methylpyrazol-4-yl)-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6R)-3-(3,5-dimethylphenyl)-4-methyl-6-(1-methyl-4-pyrazolyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (6R)-3-(3,5-dimethylphenyl)-4-methyl-6-(1-methylpyrazol-4-yl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6R)-3-(3,5-dimethylphenyl)-4-methyl-6-(1-methylpyrazol-4-yl)-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C19H22N4O2S MolecularWeight: 370.46858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=C(C(NC2=S)C3=CN(N=C3)C)C(=O)OC)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=C([C@H](NC2=S)C3=CN(N=C3)C)C(=O)OC)C)C

InChI

InChI=1S/C19H22N4O2S/c1-11-6-12(2)8-15(7-11)23-13(3)16(18(24)25-5)17(21-19(23)26)14-9-20-22(4)10-14/h6-10,17H,1-5H3,(H,21,26)/t17-/m1/s1