(2E)-5-azanyl-7-(4-bromophenyl)-2-[(4-bromophenyl)methylidene]-3-oxidanylidene-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarbonitrile

Systemtic Name: (2E)-5-azanyl-7-(4-bromophenyl)-2-[(4-bromophenyl)methylidene]-3-oxidanylidene-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarbonitrile Openeye Name: (2E)-5-amino-7-(4-bromophenyl)-2-[(4-bromophenyl)methylene]-3-oxo-7H-thiazolo[3,2-a]pyridine-6,8-dicarbonitrile CAS Name: (2E)-5-amino-7-(4-bromophenyl)-2-[(4-bromophenyl)methylidene]-3-oxo-7H-thiazolo[3,2-a]pyridine-6,8-dicarbonitrile IUPAC Name: (2E)-5-amino-7-(4-bromophenyl)-2-[(4-bromophenyl)methylidene]-3-oxo-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarbonitrile Traditional Name: (2E)-5-amino-2-(4-bromobenzylidene)-7-(4-bromophenyl)-3-keto-7H-thiazolo[3,2-a]pyridine-6,8-dicarbonitrile Formula: C22H12Br2N4OS MolecularWeight: 540.22988

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=C2C(=O)N3C(=C(C(C(=C3S2)C#N)C4=CC=C(C=C4)Br)C#N)N)Br

Isomeric SMILES

C1=CC(=CC=C1/C=C/2\C(=O)N3C(=C(C(C(=C3S2)C#N)C4=CC=C(C=C4)Br)C#N)N)Br

InChI

InChI=1S/C22H12Br2N4OS/c23-14-5-1-12(2-6-14)9-18-21(29)28-20(27)16(10-25)19(17(11-26)22(28)30-18)13-3-7-15(24)8-4-13/h1-9,19H,27H2/b18-9+