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

Systemtic Name: [2-methoxy-4-[(E)-(3-methyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] 3-bromanylbenzoate Openeye Name: [2-methoxy-4-[(E)-(3-methyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]phenyl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [2-methoxy-4-[(E)-(3-methyl-4-oxo-2-sulfanylidene-5-thiazolidinylidene)methyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [4-[(E)-(4-keto-3-methyl-2-thioxo-thiazolidin-5-ylidene)methyl]-2-methoxy-phenyl] ester Formula: C19H14BrNO4S2 MolecularWeight: 464.35276

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CC2=CC(=C(C=C2)OC(=O)C3=CC(=CC=C3)Br)OC)SC1=S

Isomeric SMILES

CN1C(=O)/C(=C\C2=CC(=C(C=C2)OC(=O)C3=CC(=CC=C3)Br)OC)/SC1=S

InChI

InChI=1S/C19H14BrNO4S2/c1-21-17(22)16(27-19(21)26)9-11-6-7-14(15(8-11)24-2)25-18(23)12-4-3-5-13(20)10-12/h3-10H,1-2H3/b16-9+