methyl 4-[2,5-dimethyl-3-[(2-methylphenyl)sulfanylmethyl]phenyl]-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: methyl 4-[2,5-dimethyl-3-[(2-methylphenyl)sulfanylmethyl]phenyl]-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: methyl 4-[2,5-dimethyl-3-(o-tolylsulfanylmethyl)phenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-[2,5-dimethyl-3-[[(2-methylphenyl)thio]methyl]phenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 4-[2,5-dimethyl-3-[(2-methylphenyl)sulfanylmethyl]phenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-[2,5-dimethyl-3-[(o-tolylthio)methyl]phenyl]-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C23H26N2O3S MolecularWeight: 410.52914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC2=C(C(=CC(=C2)C)C3C(=C(NC(=O)N3)C)C(=O)OC)C

Isomeric SMILES

CC1=CC=CC=C1SCC2=C(C(=CC(=C2)C)C3C(=C(NC(=O)N3)C)C(=O)OC)C

InChI

InChI=1S/C23H26N2O3S/c1-13-10-17(12-29-19-9-7-6-8-14(19)2)15(3)18(11-13)21-20(22(26)28-5)16(4)24-23(27)25-21/h6-11,21H,12H2,1-5H3,(H2,24,25,27)