4-[(3-bromanyl-5-chloranyl-2-methoxy-phenyl)methylidene]-2-(phenylmethylsulfanyl)-1,3-thiazol-5-one

Systemtic Name: 4-[(3-bromanyl-5-chloranyl-2-methoxy-phenyl)methylidene]-2-(phenylmethylsulfanyl)-1,3-thiazol-5-one Openeye Name: 2-benzylsulfanyl-4-[(3-bromo-5-chloro-2-methoxy-phenyl)methylene]thiazol-5-one CAS Name: 4-[(3-bromo-5-chloro-2-methoxyphenyl)methylidene]-2-(phenylmethylthio)-5-thiazolone IUPAC Name: 2-benzylsulfanyl-4-[(3-bromo-5-chloro-2-methoxyphenyl)methylidene]-1,3-thiazol-5-one Traditional Name: 2-(benzylthio)-4-(3-bromo-5-chloro-2-methoxy-benzylidene)-2-thiazolin-5-one Formula: C18H13BrClNO2S2 MolecularWeight: 454.78832

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1C=C2C(=O)SC(=N2)SCC3=CC=CC=C3)Cl)Br

Isomeric SMILES

COC1=C(C=C(C=C1C=C2C(=O)SC(=N2)SCC3=CC=CC=C3)Cl)Br

InChI

InChI=1S/C18H13BrClNO2S2/c1-23-16-12(7-13(20)9-14(16)19)8-15-17(22)25-18(21-15)24-10-11-5-3-2-4-6-11/h2-9H,10H2,1H3