methyl 3-methyl-2-oxidanylidene-6-phenyl-4-[(4,5,6-trimethylpyrimidin-2-yl)sulfanylmethyl]-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl 3-methyl-2-oxidanylidene-6-phenyl-4-[(4,5,6-trimethylpyrimidin-2-yl)sulfanylmethyl]-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl 3-methyl-2-oxo-6-phenyl-4-[(4,5,6-trimethylpyrimidin-2-yl)sulfanylmethyl]-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-methyl-2-oxo-6-phenyl-4-[[(4,5,6-trimethyl-2-pyrimidinyl)thio]methyl]-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 3-methyl-2-oxo-6-phenyl-4-[(4,5,6-trimethylpyrimidin-2-yl)sulfanylmethyl]-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 2-keto-3-methyl-6-phenyl-4-[[(4,5,6-trimethylpyrimidin-2-yl)thio]methyl]-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1C)SCC2=C(C(NC(=O)N2C)C3=CC=CC=C3)C(=O)OC)C

Isomeric SMILES

CC1=C(N=C(N=C1C)SCC2=C(C(NC(=O)N2C)C3=CC=CC=C3)C(=O)OC)C

InChI

InChI=1S/C21H24N4O3S/c1-12-13(2)22-20(23-14(12)3)29-11-16-17(19(26)28-5)18(24-21(27)25(16)4)15-9-7-6-8-10-15/h6-10,18H,11H2,1-5H3,(H,24,27)