ethyl 3-phenyl-2-sulfanylidene-1,4-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 3-phenyl-2-sulfanylidene-1,4-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-phenyl-2-thioxo-1,4-dihydropyrimidine-5-carboxylate CAS Name: 3-phenyl-2-sulfanylidene-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-phenyl-2-sulfanylidene-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 3-phenyl-2-thioxo-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C13H14N2O2S MolecularWeight: 262.32746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CNC(=S)N(C1)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=CNC(=S)N(C1)C2=CC=CC=C2

InChI

InChI=1S/C13H14N2O2S/c1-2-17-12(16)10-8-14-13(18)15(9-10)11-6-4-3-5-7-11/h3-8H,2,9H2,1H3,(H,14,18)