ethyl 5-[(E)-2-[3-(3-methyl-2-sulfanylidene-but-3-enyl)phenyl]ethenyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-[(E)-2-[3-(3-methyl-2-sulfanylidene-but-3-enyl)phenyl]ethenyl]thiophene-2-carboxylate Openeye Name: ethyl 5-[(E)-2-[3-(3-methyl-2-thioxo-but-3-enyl)phenyl]vinyl]thiophene-2-carboxylate CAS Name: 5-[(E)-2-[3-(3-methyl-2-sulfanylidenebut-3-enyl)phenyl]ethenyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(E)-2-[3-(3-methyl-2-sulfanylidenebut-3-enyl)phenyl]ethenyl]thiophene-2-carboxylate Traditional Name: 5-[(E)-2-[3-(3-methyl-2-thioxo-but-3-enyl)phenyl]vinyl]thiophene-2-carboxylic acid ethyl ester Formula: C20H20O2S2 MolecularWeight: 356.5016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(S1)C=CC2=CC(=CC=C2)CC(=S)C(=C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(S1)/C=C/C2=CC(=CC=C2)CC(=S)C(=C)C

InChI

InChI=1S/C20H20O2S2/c1-4-22-20(21)19-11-10-17(24-19)9-8-15-6-5-7-16(12-15)13-18(23)14(2)3/h5-12H,2,4,13H2,1,3H3/b9-8+