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

Systemtic Name: [4-bromanyl-2-[[4-oxidanylidene-3-(phenylmethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]phenyl] methanesulfonate Openeye Name: [2-[(3-benzyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]-4-bromo-phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-bromo-2-[[4-oxo-3-(phenylmethyl)-2-sulfanylidene-5-thiazolidinylidene]methyl]phenyl] ester IUPAC Name: [2-[(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-4-bromophenyl] methanesulfonate Traditional Name: methanesulfonic acid [2-[(3-benzyl-4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]-4-bromo-phenyl] ester Formula: C18H14BrNO4S3 MolecularWeight: 484.40706

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1=C(C=C(C=C1)Br)C=C2C(=O)N(C(=S)S2)CC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)OC1=C(C=C(C=C1)Br)C=C2C(=O)N(C(=S)S2)CC3=CC=CC=C3

InChI

InChI=1S/C18H14BrNO4S3/c1-27(22,23)24-15-8-7-14(19)9-13(15)10-16-17(21)20(18(25)26-16)11-12-5-3-2-4-6-12/h2-10H,11H2,1H3