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

Systemtic Name: prop-2-ynyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: prop-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 prop-2-ynyl ester IUPAC Name: prop-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 propargyl ester Formula: C9H10N2O2S MolecularWeight: 210.2529

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CNC(=S)N1)C(=O)OCC#C

Isomeric SMILES

CC1=C(CNC(=S)N1)C(=O)OCC#C

InChI

InChI=1S/C9H10N2O2S/c1-3-4-13-8(12)7-5-10-9(14)11-6(7)2/h1H,4-5H2,2H3,(H2,10,11,14)