2-bromanyl-3-[4-(4-cyanophenyl)phenyl]-6-oxidanyl-4-oxidanylidene-7H-thieno[2,3-b]pyridine-5-carbonitrile

Systemtic Name: 2-bromanyl-3-[4-(4-cyanophenyl)phenyl]-6-oxidanyl-4-oxidanylidene-7H-thieno[2,3-b]pyridine-5-carbonitrile Openeye Name: 2-bromo-3-[4-(4-cyanophenyl)phenyl]-6-hydroxy-4-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrile CAS Name: 2-bromo-3-[4-(4-cyanophenyl)phenyl]-6-hydroxy-4-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrile IUPAC Name: 2-bromo-3-[4-(4-cyanophenyl)phenyl]-6-hydroxy-4-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrile Traditional Name: 2-bromo-3-[4-(4-cyanophenyl)phenyl]-6-hydroxy-4-keto-7H-thieno[2,3-b]pyridine-5-carbonitrile Formula: C21H10BrN3O2S MolecularWeight: 448.292

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C2=CC=C(C=C2)C3=C(SC4=C3C(=O)C(=C(N4)O)C#N)Br

Isomeric SMILES

C1=CC(=CC=C1C#N)C2=CC=C(C=C2)C3=C(SC4=C3C(=O)C(=C(N4)O)C#N)Br

InChI

InChI=1S/C21H10BrN3O2S/c22-19-16(17-18(26)15(10-24)20(27)25-21(17)28-19)14-7-5-13(6-8-14)12-3-1-11(9-23)2-4-12/h1-8H,(H2,25,26,27)