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

Systemtic Name: 2-bromanyl-6-oxidanyl-4-oxidanylidene-3-[4-(5-oxidanylpent-1-ynyl)phenyl]-7H-thieno[2,3-b]pyridine-5-carbonitrile Openeye Name: 2-bromo-6-hydroxy-3-[4-(5-hydroxypent-1-ynyl)phenyl]-4-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrile CAS Name: 2-bromo-6-hydroxy-3-[4-(5-hydroxypent-1-ynyl)phenyl]-4-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrile IUPAC Name: 2-bromo-6-hydroxy-3-[4-(5-hydroxypent-1-ynyl)phenyl]-4-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrile Traditional Name: 2-bromo-6-hydroxy-3-[4-(5-hydroxypent-1-ynyl)phenyl]-4-keto-7H-thieno[2,3-b]pyridine-5-carbonitrile Formula: C19H13BrN2O3S MolecularWeight: 429.28712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H13BrN2O3S/c20-17-14(12-7-5-11(6-8-12)4-2-1-3-9-23)15-16(24)13(10-21)18(25)22-19(15)26-17/h5-8,23H,1,3,9H2,(H2,22,24,25)