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

Systemtic Name: 3-[4-(4-cyanobut-1-ynyl)phenyl]-6-oxidanyl-4-oxidanylidene-7H-thieno[2,3-b]pyridine-5-carbonitrile Openeye Name: 3-[4-(4-cyanobut-1-ynyl)phenyl]-6-hydroxy-4-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrile CAS Name: 3-[4-(4-cyanobut-1-ynyl)phenyl]-6-hydroxy-4-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrile IUPAC Name: 3-[4-(4-cyanobut-1-ynyl)phenyl]-6-hydroxy-4-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrile Traditional Name: 3-[4-(4-cyanobut-1-ynyl)phenyl]-6-hydroxy-4-keto-7H-thieno[2,3-b]pyridine-5-carbonitrile Formula: C19H11N3O2S MolecularWeight: 345.37454

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#CCCC#N)C2=CSC3=C2C(=O)C(=C(N3)O)C#N

Isomeric SMILES

C1=CC(=CC=C1C#CCCC#N)C2=CSC3=C2C(=O)C(=C(N3)O)C#N

InChI

InChI=1S/C19H11N3O2S/c20-9-3-1-2-4-12-5-7-13(8-6-12)15-11-25-19-16(15)17(23)14(10-21)18(24)22-19/h5-8,11H,1,3H2,(H2,22,23,24)