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

Systemtic Name: ethyl 4-[2,5-dimethyl-3-[(4-methylphenyl)sulfanylmethyl]phenyl]-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[2,5-dimethyl-3-(p-tolylsulfanylmethyl)phenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-[2,5-dimethyl-3-[[(4-methylphenyl)thio]methyl]phenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[2,5-dimethyl-3-[(4-methylphenyl)sulfanylmethyl]phenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-[2,5-dimethyl-3-[(p-tolylthio)methyl]phenyl]-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C24H28N2O3S MolecularWeight: 424.55572

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC(=CC(=C2C)CSC3=CC=C(C=C3)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC(=CC(=C2C)CSC3=CC=C(C=C3)C)C)C

InChI

InChI=1S/C24H28N2O3S/c1-6-29-23(27)21-17(5)25-24(28)26-22(21)20-12-15(3)11-18(16(20)4)13-30-19-9-7-14(2)8-10-19/h7-12,22H,6,13H2,1-5H3,(H2,25,26,28)