[4-bromanyl-3-[[5-oxidanylidene-2-(phenylmethylsulfanyl)-1,3-thiazol-4-ylidene]methyl]phenyl] ethanoate

Systemtic Name: [4-bromanyl-3-[[5-oxidanylidene-2-(phenylmethylsulfanyl)-1,3-thiazol-4-ylidene]methyl]phenyl] ethanoate Openeye Name: [3-[(2-benzylsulfanyl-5-oxo-thiazol-4-ylidene)methyl]-4-bromo-phenyl] acetate CAS Name: acetic acid [4-bromo-3-[[5-oxo-2-(phenylmethylthio)-4-thiazolylidene]methyl]phenyl] ester IUPAC Name: [3-[(2-benzylsulfanyl-5-oxo-1,3-thiazol-4-ylidene)methyl]-4-bromophenyl] acetate Traditional Name: acetic acid [3-[[2-(benzylthio)-5-keto-2-thiazolin-4-ylidene]methyl]-4-bromo-phenyl] ester Formula: C19H14BrNO3S2 MolecularWeight: 448.35336

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC(=C(C=C1)Br)C=C2C(=O)SC(=N2)SCC3=CC=CC=C3

Isomeric SMILES

CC(=O)OC1=CC(=C(C=C1)Br)C=C2C(=O)SC(=N2)SCC3=CC=CC=C3

InChI

InChI=1S/C19H14BrNO3S2/c1-12(22)24-15-7-8-16(20)14(9-15)10-17-18(23)26-19(21-17)25-11-13-5-3-2-4-6-13/h2-10H,11H2,1H3