ethyl 6-[(2,5-dimethylphenyl)sulfanylmethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[(2,5-dimethylphenyl)sulfanylmethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[(2,5-dimethylphenyl)sulfanylmethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[(2,5-dimethylphenyl)thio]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[(2,5-dimethylphenyl)sulfanylmethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[[(2,5-dimethylphenyl)thio]methyl]-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C16H20N2O3S MolecularWeight: 320.4066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1)CSC2=C(C=CC(=C2)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1)CSC2=C(C=CC(=C2)C)C

InChI

InChI=1S/C16H20N2O3S/c1-4-21-15(19)12-8-17-16(20)18-13(12)9-22-14-7-10(2)5-6-11(14)3/h5-7H,4,8-9H2,1-3H3,(H2,17,18,20)