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

Systemtic Name: [2-methoxy-4-[(E)-(4-oxidanylidene-3-propyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] benzoate Openeye Name: [2-methoxy-4-[(E)-(4-oxo-3-propyl-2-thioxo-thiazolidin-5-ylidene)methyl]phenyl] benzoate CAS Name: benzoic acid [2-methoxy-4-[(E)-(4-oxo-3-propyl-2-sulfanylidene-5-thiazolidinylidene)methyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-(4-oxo-3-propyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] benzoate Traditional Name: benzoic acid [4-[(E)-(4-keto-3-propyl-2-thioxo-thiazolidin-5-ylidene)methyl]-2-methoxy-phenyl] ester Formula: C21H19NO4S2 MolecularWeight: 413.50986

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C(=CC2=CC(=C(C=C2)OC(=O)C3=CC=CC=C3)OC)SC1=S

Isomeric SMILES

CCCN1C(=O)/C(=C\C2=CC(=C(C=C2)OC(=O)C3=CC=CC=C3)OC)/SC1=S

InChI

InChI=1S/C21H19NO4S2/c1-3-11-22-19(23)18(28-21(22)27)13-14-9-10-16(17(12-14)25-2)26-20(24)15-7-5-4-6-8-15/h4-10,12-13H,3,11H2,1-2H3/b18-13+