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

Systemtic Name: dec-3-ynyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: dec-3-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 dec-3-ynyl ester IUPAC Name: dec-3-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 dec-3-ynyl ester Formula: C16H24N2O2S MolecularWeight: 308.43896

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CCCOC(=O)C1=C(NC(=S)NC1)C

Isomeric SMILES

CCCCCCC#CCCOC(=O)C1=C(NC(=S)NC1)C

InChI

InChI=1S/C16H24N2O2S/c1-3-4-5-6-7-8-9-10-11-20-15(19)14-12-17-16(21)18-13(14)2/h3-7,10-12H2,1-2H3,(H2,17,18,21)