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

Systemtic Name: [5-bromanyl-2-methoxy-4-[(2-methylsulfanyl-5-oxidanylidene-1,3-thiazol-4-ylidene)methyl]phenyl] ethanoate Openeye Name: [5-bromo-2-methoxy-4-[(2-methylsulfanyl-5-oxo-thiazol-4-ylidene)methyl]phenyl] acetate CAS Name: acetic acid [5-bromo-2-methoxy-4-[[2-(methylthio)-5-oxo-4-thiazolylidene]methyl]phenyl] ester IUPAC Name: [5-bromo-2-methoxy-4-[(2-methylsulfanyl-5-oxo-1,3-thiazol-4-ylidene)methyl]phenyl] acetate Traditional Name: acetic acid [5-bromo-4-[[5-keto-2-(methylthio)-2-thiazolin-4-ylidene]methyl]-2-methoxy-phenyl] ester Formula: C14H12BrNO4S2 MolecularWeight: 402.28338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12BrNO4S2/c1-7(17)20-12-6-9(15)8(5-11(12)19-2)4-10-13(18)22-14(16-10)21-3/h4-6H,1-3H3