(4-ethoxyphenyl)methyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: (4-ethoxyphenyl)methyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: (4-ethoxyphenyl)methyl 6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid (4-ethoxyphenyl)methyl ester IUPAC Name: (4-ethoxyphenyl)methyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid (4-ethoxybenzyl) ester Formula: C15H18N2O3S MolecularWeight: 306.38002

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)COC(=O)C2=C(NC(=S)NC2)C

Isomeric SMILES

CCOC1=CC=C(C=C1)COC(=O)C2=C(NC(=S)NC2)C

InChI

InChI=1S/C15H18N2O3S/c1-3-19-12-6-4-11(5-7-12)9-20-14(18)13-8-16-15(21)17-10(13)2/h4-7H,3,8-9H2,1-2H3,(H2,16,17,21)