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

Systemtic Name: 4-[(3-bromanyl-4-ethoxy-5-methoxy-phenyl)methylidene]-2-(phenylmethylsulfanyl)-1,3-thiazol-5-one Openeye Name: 2-benzylsulfanyl-4-[(3-bromo-4-ethoxy-5-methoxy-phenyl)methylene]thiazol-5-one CAS Name: 4-[(3-bromo-4-ethoxy-5-methoxyphenyl)methylidene]-2-(phenylmethylthio)-5-thiazolone IUPAC Name: 2-benzylsulfanyl-4-[(3-bromo-4-ethoxy-5-methoxyphenyl)methylidene]-1,3-thiazol-5-one Traditional Name: 2-(benzylthio)-4-(3-bromo-4-ethoxy-5-methoxy-benzylidene)-2-thiazolin-5-one Formula: C20H18BrNO3S2 MolecularWeight: 464.39582

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C=C2C(=O)SC(=N2)SCC3=CC=CC=C3)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C=C2C(=O)SC(=N2)SCC3=CC=CC=C3)OC

InChI

InChI=1S/C20H18BrNO3S2/c1-3-25-18-15(21)9-14(11-17(18)24-2)10-16-19(23)27-20(22-16)26-12-13-7-5-4-6-8-13/h4-11H,3,12H2,1-2H3