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

Systemtic Name: [4-bromanyl-2-[(4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] benzenesulfonate Openeye Name: [2-[(3-allyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]-4-bromo-phenyl] benzenesulfonate CAS Name: benzenesulfonic acid [4-bromo-2-[(4-oxo-3-prop-2-enyl-2-sulfanylidene-5-thiazolidinylidene)methyl]phenyl] ester IUPAC Name: [4-bromo-2-[(4-oxo-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] benzenesulfonate Traditional Name: benzenesulfonic acid [2-[(3-allyl-4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]-4-bromo-phenyl] ester Formula: C19H14BrNO4S3 MolecularWeight: 496.41776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C(=CC2=C(C=CC(=C2)Br)OS(=O)(=O)C3=CC=CC=C3)SC1=S

Isomeric SMILES

C=CCN1C(=O)C(=CC2=C(C=CC(=C2)Br)OS(=O)(=O)C3=CC=CC=C3)SC1=S

InChI

InChI=1S/C19H14BrNO4S3/c1-2-10-21-18(22)17(27-19(21)26)12-13-11-14(20)8-9-16(13)25-28(23,24)15-6-4-3-5-7-15/h2-9,11-12H,1,10H2