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

Systemtic Name: [3-[(4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] 2-iodanylbenzoate Openeye Name: [3-[(3-allyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]phenyl] 2-iodobenzoate CAS Name: 2-iodobenzoic acid [3-[(4-oxo-3-prop-2-enyl-2-sulfanylidene-5-thiazolidinylidene)methyl]phenyl] ester IUPAC Name: [3-[(4-oxo-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] 2-iodobenzoate Traditional Name: 2-iodobenzoic acid [3-[(3-allyl-4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]phenyl] ester Formula: C20H14INO3S2 MolecularWeight: 507.36453

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C(=CC2=CC(=CC=C2)OC(=O)C3=CC=CC=C3I)SC1=S

Isomeric SMILES

C=CCN1C(=O)C(=CC2=CC(=CC=C2)OC(=O)C3=CC=CC=C3I)SC1=S

InChI

InChI=1S/C20H14INO3S2/c1-2-10-22-18(23)17(27-20(22)26)12-13-6-5-7-14(11-13)25-19(24)15-8-3-4-9-16(15)21/h2-9,11-12H,1,10H2