[2-[(4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] 4-methoxybenzoate

Systemtic Name: [2-[(4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] 4-methoxybenzoate Openeye Name: [2-[(3-allyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]phenyl] 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid [2-[(4-oxo-3-prop-2-enyl-2-sulfanylidene-5-thiazolidinylidene)methyl]phenyl] ester IUPAC Name: [2-[(4-oxo-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [2-[(3-allyl-4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]phenyl] ester Formula: C21H17NO4S2 MolecularWeight: 411.49398

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2C=C3C(=O)N(C(=S)S3)CC=C

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2C=C3C(=O)N(C(=S)S3)CC=C

InChI

InChI=1S/C21H17NO4S2/c1-3-12-22-19(23)18(28-21(22)27)13-15-6-4-5-7-17(15)26-20(24)14-8-10-16(25-2)11-9-14/h3-11,13H,1,12H2,2H3