thiophen-3-ylmethyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: thiophen-3-ylmethyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: 3-thienylmethyl 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 3-thiophenylmethyl ester IUPAC Name: thiophen-3-ylmethyl 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 3-thenyl ester Formula: C11H12N2O2S2 MolecularWeight: 268.35518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CNC(=S)N1)C(=O)OCC2=CSC=C2

Isomeric SMILES

CC1=C(CNC(=S)N1)C(=O)OCC2=CSC=C2

InChI

InChI=1S/C11H12N2O2S2/c1-7-9(4-12-11(16)13-7)10(14)15-5-8-2-3-17-6-8/h2-3,6H,4-5H2,1H3,(H2,12,13,16)