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

Systemtic Name: 2-[5-[(5-bromanyl-2-methoxy-phenyl)methylidene]-3-(2-methylphenyl)-4-oxidanylidene-1,3-thiazolidin-2-ylidene]propanedinitrile Openeye Name: 2-[5-[(5-bromo-2-methoxy-phenyl)methylene]-3-(o-tolyl)-4-oxo-thiazolidin-2-ylidene]propanedinitrile CAS Name: 2-[5-[(5-bromo-2-methoxyphenyl)methylidene]-3-(2-methylphenyl)-4-oxo-2-thiazolidinylidene]propanedinitrile IUPAC Name: 2-[5-[(5-bromo-2-methoxyphenyl)methylidene]-3-(2-methylphenyl)-4-oxo-1,3-thiazolidin-2-ylidene]propanedinitrile Traditional Name: 2-[5-(5-bromo-2-methoxy-benzylidene)-4-keto-3-(o-tolyl)thiazolidin-2-ylidene]malononitrile Formula: C21H14BrN3O2S MolecularWeight: 452.32376

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H14BrN3O2S/c1-13-5-3-4-6-17(13)25-20(26)19(28-21(25)15(11-23)12-24)10-14-9-16(22)7-8-18(14)27-2/h3-10H,1-2H3