2-[5-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-3-(2,5-dimethylphenyl)-4-oxidanylidene-1,3-thiazolidin-2-ylidene]propanedinitrile

Systemtic Name: 2-[5-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-3-(2,5-dimethylphenyl)-4-oxidanylidene-1,3-thiazolidin-2-ylidene]propanedinitrile Openeye Name: 2-[5-[(3-bromo-4-hydroxy-5-methoxy-phenyl)methylene]-3-(2,5-dimethylphenyl)-4-oxo-thiazolidin-2-ylidene]propanedinitrile CAS Name: 2-[5-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-3-(2,5-dimethylphenyl)-4-oxo-2-thiazolidinylidene]propanedinitrile IUPAC Name: 2-[5-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-3-(2,5-dimethylphenyl)-4-oxo-1,3-thiazolidin-2-ylidene]propanedinitrile Traditional Name: 2-[5-(3-bromo-4-hydroxy-5-methoxy-benzylidene)-3-(2,5-dimethylphenyl)-4-keto-thiazolidin-2-ylidene]malononitrile Formula: C22H16BrN3O3S MolecularWeight: 482.34974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=O)C(=CC3=CC(=C(C(=C3)Br)O)OC)SC2=C(C#N)C#N

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=O)C(=CC3=CC(=C(C(=C3)Br)O)OC)SC2=C(C#N)C#N

InChI

InChI=1S/C22H16BrN3O3S/c1-12-4-5-13(2)17(6-12)26-21(28)19(30-22(26)15(10-24)11-25)9-14-7-16(23)20(27)18(8-14)29-3/h4-9,27H,1-3H3