[2-methoxy-4-[(E)-(5-oxidanylidene-1-prop-2-enyl-2-sulfanylidene-imidazolidin-4-ylidene)methyl]phenyl] thiophene-2-carboxylate

Systemtic Name: [2-methoxy-4-[(E)-(5-oxidanylidene-1-prop-2-enyl-2-sulfanylidene-imidazolidin-4-ylidene)methyl]phenyl] thiophene-2-carboxylate Openeye Name: [4-[(E)-(1-allyl-5-oxo-2-thioxo-imidazolidin-4-ylidene)methyl]-2-methoxy-phenyl] thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [2-methoxy-4-[(E)-(5-oxo-1-prop-2-enyl-2-sulfanylidene-4-imidazolidinylidene)methyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-(5-oxo-1-prop-2-enyl-2-sulfanylideneimidazolidin-4-ylidene)methyl]phenyl] thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [4-[(E)-(1-allyl-5-keto-2-thioxo-imidazolidin-4-ylidene)methyl]-2-methoxy-phenyl] ester Formula: C19H16N2O4S2 MolecularWeight: 400.47134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)N2)CC=C)OC(=O)C3=CC=CS3

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/2\C(=O)N(C(=S)N2)CC=C)OC(=O)C3=CC=CS3

InChI

InChI=1S/C19H16N2O4S2/c1-3-8-21-17(22)13(20-19(21)26)10-12-6-7-14(15(11-12)24-2)25-18(23)16-5-4-9-27-16/h3-7,9-11H,1,8H2,2H3,(H,20,26)/b13-10+