ethyl 4-azanyl-3-(3-methylsulfanylphenyl)-2-sulfanylidene-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-azanyl-3-(3-methylsulfanylphenyl)-2-sulfanylidene-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-amino-3-(3-methylsulfanylphenyl)-2-thioxo-thiazole-5-carboxylate CAS Name: 4-amino-3-[3-(methylthio)phenyl]-2-sulfanylidene-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-3-(3-methylsulfanylphenyl)-2-sulfanylidene-1,3-thiazole-5-carboxylate Traditional Name: 4-amino-3-[3-(methylthio)phenyl]-2-thioxo-4-thiazoline-5-carboxylic acid ethyl ester Formula: C13H14N2O2S3 MolecularWeight: 326.45746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=S)S1)C2=CC(=CC=C2)SC)N

Isomeric SMILES

CCOC(=O)C1=C(N(C(=S)S1)C2=CC(=CC=C2)SC)N

InChI

InChI=1S/C13H14N2O2S3/c1-3-17-12(16)10-11(14)15(13(18)20-10)8-5-4-6-9(7-8)19-2/h4-7H,3,14H2,1-2H3