3-(5-bromanylthiophen-2-yl)-2-chloranyl-6-oxidanyl-4-oxidanylidene-7H-thieno[2,3-b]pyridine-5-carbonitrile

Systemtic Name: 3-(5-bromanylthiophen-2-yl)-2-chloranyl-6-oxidanyl-4-oxidanylidene-7H-thieno[2,3-b]pyridine-5-carbonitrile Openeye Name: 3-(5-bromo-2-thienyl)-2-chloro-6-hydroxy-4-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrile CAS Name: 3-(5-bromo-2-thiophenyl)-2-chloro-6-hydroxy-4-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrile IUPAC Name: 3-(5-bromothiophen-2-yl)-2-chloro-6-hydroxy-4-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrile Traditional Name: 3-(5-bromo-2-thienyl)-2-chloro-6-hydroxy-4-keto-7H-thieno[2,3-b]pyridine-5-carbonitrile Formula: C12H4BrClN2O2S2 MolecularWeight: 387.65936

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1)Br)C2=C(SC3=C2C(=O)C(=C(N3)O)C#N)Cl

Isomeric SMILES

C1=C(SC(=C1)Br)C2=C(SC3=C2C(=O)C(=C(N3)O)C#N)Cl

InChI

InChI=1S/C12H4BrClN2O2S2/c13-6-2-1-5(19-6)7-8-9(17)4(3-15)11(18)16-12(8)20-10(7)14/h1-2H,(H2,16,17,18)