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

Systemtic Name: 3-[4-(2-methylphenyl)phenyl]-6-oxidanyl-4-oxidanylidene-7H-thieno[2,3-b]pyridine-5-carbonitrile Openeye Name: 6-hydroxy-3-[4-(o-tolyl)phenyl]-4-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrile CAS Name: 6-hydroxy-3-[4-(2-methylphenyl)phenyl]-4-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrile IUPAC Name: 6-hydroxy-3-[4-(2-methylphenyl)phenyl]-4-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrile Traditional Name: 6-hydroxy-4-keto-3-[4-(o-tolyl)phenyl]-7H-thieno[2,3-b]pyridine-5-carbonitrile Formula: C21H14N2O2S MolecularWeight: 358.41306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC=C(C=C2)C3=CSC4=C3C(=O)C(=C(N4)O)C#N

Isomeric SMILES

CC1=CC=CC=C1C2=CC=C(C=C2)C3=CSC4=C3C(=O)C(=C(N4)O)C#N

InChI

InChI=1S/C21H14N2O2S/c1-12-4-2-3-5-15(12)13-6-8-14(9-7-13)17-11-26-21-18(17)19(24)16(10-22)20(25)23-21/h2-9,11H,1H3,(H2,23,24,25)