2-bromanyl-6-oxidanyl-3-[4-(4-oxidanylbut-1-ynyl)phenyl]-4-oxidanylidene-7H-thieno[2,3-b]pyridine-5-carbonitrile

Systemtic Name: 2-bromanyl-6-oxidanyl-3-[4-(4-oxidanylbut-1-ynyl)phenyl]-4-oxidanylidene-7H-thieno[2,3-b]pyridine-5-carbonitrile Openeye Name: 2-bromo-6-hydroxy-3-[4-(4-hydroxybut-1-ynyl)phenyl]-4-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrile CAS Name: 2-bromo-6-hydroxy-3-[4-(4-hydroxybut-1-ynyl)phenyl]-4-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrile IUPAC Name: 2-bromo-6-hydroxy-3-[4-(4-hydroxybut-1-ynyl)phenyl]-4-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrile Traditional Name: 2-bromo-6-hydroxy-3-[4-(4-hydroxybut-1-ynyl)phenyl]-4-keto-7H-thieno[2,3-b]pyridine-5-carbonitrile Formula: C18H11BrN2O3S MolecularWeight: 415.26054

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#CCCO)C2=C(SC3=C2C(=O)C(=C(N3)O)C#N)Br

Isomeric SMILES

C1=CC(=CC=C1C#CCCO)C2=C(SC3=C2C(=O)C(=C(N3)O)C#N)Br

InChI

InChI=1S/C18H11BrN2O3S/c19-16-13(11-6-4-10(5-7-11)3-1-2-8-22)14-15(23)12(9-20)17(24)21-18(14)25-16/h4-7,22H,2,8H2,(H2,21,23,24)