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

Systemtic Name: 2-chloranyl-3-[4-(2-methylphenyl)phenyl]-6-oxidanyl-4-oxidanylidene-7H-thieno[2,3-b]pyridine-5-carbonitrile Openeye Name: 2-chloro-6-hydroxy-3-[4-(o-tolyl)phenyl]-4-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrile CAS Name: 2-chloro-6-hydroxy-3-[4-(2-methylphenyl)phenyl]-4-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrile IUPAC Name: 2-chloro-6-hydroxy-3-[4-(2-methylphenyl)phenyl]-4-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrile Traditional Name: 2-chloro-6-hydroxy-4-keto-3-[4-(o-tolyl)phenyl]-7H-thieno[2,3-b]pyridine-5-carbonitrile Formula: C21H13ClN2O2S MolecularWeight: 392.85812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC=C(C=C2)C3=C(SC4=C3C(=O)C(=C(N4)O)C#N)Cl

Isomeric SMILES

CC1=CC=CC=C1C2=CC=C(C=C2)C3=C(SC4=C3C(=O)C(=C(N4)O)C#N)Cl

InChI

InChI=1S/C21H13ClN2O2S/c1-11-4-2-3-5-14(11)12-6-8-13(9-7-12)16-17-18(25)15(10-23)20(26)24-21(17)27-19(16)22/h2-9H,1H3,(H2,24,25,26)