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

Systemtic Name: 2-[5-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-3-(2-methylphenyl)-4-oxidanylidene-1,3-thiazolidin-2-ylidene]propanedinitrile Openeye Name: 2-[5-[(3-bromo-4-hydroxy-5-methoxy-phenyl)methylene]-3-(o-tolyl)-4-oxo-thiazolidin-2-ylidene]propanedinitrile CAS Name: 2-[5-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-3-(2-methylphenyl)-4-oxo-2-thiazolidinylidene]propanedinitrile IUPAC Name: 2-[5-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-3-(2-methylphenyl)-4-oxo-1,3-thiazolidin-2-ylidene]propanedinitrile Traditional Name: 2-[5-(3-bromo-4-hydroxy-5-methoxy-benzylidene)-4-keto-3-(o-tolyl)thiazolidin-2-ylidene]malononitrile Formula: C21H14BrN3O3S MolecularWeight: 468.32316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C(=CC3=CC(=C(C(=C3)Br)O)OC)SC2=C(C#N)C#N

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C(=CC3=CC(=C(C(=C3)Br)O)OC)SC2=C(C#N)C#N

InChI

InChI=1S/C21H14BrN3O3S/c1-12-5-3-4-6-16(12)25-20(27)18(29-21(25)14(10-23)11-24)9-13-7-15(22)19(26)17(8-13)28-2/h3-9,26H,1-2H3