[2-bromanyl-4-[(3-methyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] benzenesulfonate

Systemtic Name: [2-bromanyl-4-[(3-methyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] benzenesulfonate Openeye Name: [2-bromo-4-[(3-methyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]phenyl] benzenesulfonate CAS Name: benzenesulfonic acid [2-bromo-4-[(3-methyl-4-oxo-2-sulfanylidene-5-thiazolidinylidene)methyl]phenyl] ester IUPAC Name: [2-bromo-4-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] benzenesulfonate Traditional Name: benzenesulfonic acid [2-bromo-4-[(4-keto-3-methyl-2-thioxo-thiazolidin-5-ylidene)methyl]phenyl] ester Formula: C17H12BrNO4S3 MolecularWeight: 470.38048

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12BrNO4S3/c1-19-16(20)15(25-17(19)24)10-11-7-8-14(13(18)9-11)23-26(21,22)12-5-3-2-4-6-12/h2-10H,1H3