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

Systemtic Name: ethyl 6-[(2-methylphenyl)methylsulfanylmethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-(o-tolylmethylsulfanylmethyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[(2-methylphenyl)methylthio]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[(2-methylphenyl)methylsulfanylmethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 2-keto-6-[[(2-methylbenzyl)thio]methyl]-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)CSCC2=CC=CC=C2C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1)CSCC2=CC=CC=C2C

InChI

InChI=1S/C16H20N2O3S/c1-3-21-15(19)13-8-17-16(20)18-14(13)10-22-9-12-7-5-4-6-11(12)2/h4-7H,3,8-10H2,1-2H3,(H2,17,18,20)