4-ethoxybut-2-ynyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: 4-ethoxybut-2-ynyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: 4-ethoxybut-2-ynyl 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-ethoxybut-2-ynyl ester IUPAC Name: 4-ethoxybut-2-ynyl 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-ethoxybut-2-ynyl ester Formula: C12H16N2O3S MolecularWeight: 268.33204

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC#CCOC(=O)C1=C(NC(=S)NC1)C

Isomeric SMILES

CCOCC#CCOC(=O)C1=C(NC(=S)NC1)C

InChI

InChI=1S/C12H16N2O3S/c1-3-16-6-4-5-7-17-11(15)10-8-13-12(18)14-9(10)2/h3,6-8H2,1-2H3,(H2,13,14,18)