[4-[(E)-[3-(furan-2-ylmethyl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-2-methoxy-phenyl] benzoate

Systemtic Name: [4-[(E)-[3-(furan-2-ylmethyl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-2-methoxy-phenyl] benzoate Openeye Name: [4-[(E)-[3-(2-furylmethyl)-4-oxo-2-thioxo-thiazolidin-5-ylidene]methyl]-2-methoxy-phenyl] benzoate CAS Name: benzoic acid [4-[(E)-[3-(2-furanylmethyl)-4-oxo-2-sulfanylidene-5-thiazolidinylidene]methyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-[3-(furan-2-ylmethyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-2-methoxyphenyl] benzoate Traditional Name: benzoic acid [4-[(E)-[3-(2-furfuryl)-4-keto-2-thioxo-thiazolidin-5-ylidene]methyl]-2-methoxy-phenyl] ester Formula: C23H17NO5S2 MolecularWeight: 451.51478

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)CC3=CC=CO3)OC(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/2\C(=O)N(C(=S)S2)CC3=CC=CO3)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H17NO5S2/c1-27-19-12-15(9-10-18(19)29-22(26)16-6-3-2-4-7-16)13-20-21(25)24(23(30)31-20)14-17-8-5-11-28-17/h2-13H,14H2,1H3/b20-13+