3-[4-(hydroxymethyl)phenyl]-6-oxidanyl-4-oxidanylidene-7,7a-dihydro-3aH-thieno[2,3-b]pyridine-5-carbonitrile

Systemtic Name: 3-[4-(hydroxymethyl)phenyl]-6-oxidanyl-4-oxidanylidene-7,7a-dihydro-3aH-thieno[2,3-b]pyridine-5-carbonitrile Openeye Name: 6-hydroxy-3-[4-(hydroxymethyl)phenyl]-4-oxo-7,7a-dihydro-3aH-thieno[2,3-b]pyridine-5-carbonitrile CAS Name: 6-hydroxy-3-[4-(hydroxymethyl)phenyl]-4-oxo-7,7a-dihydro-3aH-thieno[2,3-b]pyridine-5-carbonitrile IUPAC Name: 6-hydroxy-3-[4-(hydroxymethyl)phenyl]-4-oxo-7,7a-dihydro-3aH-thieno[2,3-b]pyridine-5-carbonitrile Traditional Name: 6-hydroxy-4-keto-3-(4-methylolphenyl)-7,7a-dihydro-3aH-thieno[2,3-b]pyridine-5-carbonitrile Formula: C15H12N2O3S MolecularWeight: 300.33238

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CO)C2=CSC3C2C(=O)C(=C(N3)O)C#N

Isomeric SMILES

C1=CC(=CC=C1CO)C2=CSC3C2C(=O)C(=C(N3)O)C#N

InChI

InChI=1S/C15H12N2O3S/c16-5-10-13(19)12-11(7-21-15(12)17-14(10)20)9-3-1-8(6-18)2-4-9/h1-4,7,12,15,17-18,20H,6H2