[2-bromanyl-6-methoxy-4-[[5-oxidanylidene-2-(phenylmethylsulfanyl)-1,3-thiazol-4-ylidene]methyl]phenyl] ethanoate

Systemtic Name: [2-bromanyl-6-methoxy-4-[[5-oxidanylidene-2-(phenylmethylsulfanyl)-1,3-thiazol-4-ylidene]methyl]phenyl] ethanoate Openeye Name: [4-[(2-benzylsulfanyl-5-oxo-thiazol-4-ylidene)methyl]-2-bromo-6-methoxy-phenyl] acetate CAS Name: acetic acid [2-bromo-6-methoxy-4-[[5-oxo-2-(phenylmethylthio)-4-thiazolylidene]methyl]phenyl] ester IUPAC Name: [4-[(2-benzylsulfanyl-5-oxo-1,3-thiazol-4-ylidene)methyl]-2-bromo-6-methoxyphenyl] acetate Traditional Name: acetic acid [4-[[2-(benzylthio)-5-keto-2-thiazolin-4-ylidene]methyl]-2-bromo-6-methoxy-phenyl] ester Formula: C20H16BrNO4S2 MolecularWeight: 478.37934

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1Br)C=C2C(=O)SC(=N2)SCC3=CC=CC=C3)OC

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1Br)C=C2C(=O)SC(=N2)SCC3=CC=CC=C3)OC

InChI

InChI=1S/C20H16BrNO4S2/c1-12(23)26-18-15(21)8-14(10-17(18)25-2)9-16-19(24)28-20(22-16)27-11-13-6-4-3-5-7-13/h3-10H,11H2,1-2H3