2-chloranyl-3-(3,4-dimethyl-2-oxidanyl-phenyl)-6-oxidanyl-5-phenyl-7H-thieno[2,3-b]pyridin-4-one

Systemtic Name: 2-chloranyl-3-(3,4-dimethyl-2-oxidanyl-phenyl)-6-oxidanyl-5-phenyl-7H-thieno[2,3-b]pyridin-4-one Openeye Name: 2-chloro-6-hydroxy-3-(2-hydroxy-3,4-dimethyl-phenyl)-5-phenyl-7H-thieno[2,3-b]pyridin-4-one CAS Name: 2-chloro-6-hydroxy-3-(2-hydroxy-3,4-dimethylphenyl)-5-phenyl-7H-thieno[2,3-b]pyridin-4-one IUPAC Name: 2-chloro-6-hydroxy-3-(2-hydroxy-3,4-dimethylphenyl)-5-phenyl-7H-thieno[2,3-b]pyridin-4-one Traditional Name: 2-chloro-6-hydroxy-3-(2-hydroxy-3,4-dimethyl-phenyl)-5-phenyl-7H-thieno[2,3-b]pyridin-4-one Formula: C21H16ClNO3S MolecularWeight: 397.87464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C2=C(SC3=C2C(=O)C(=C(N3)O)C4=CC=CC=C4)Cl)O)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C2=C(SC3=C2C(=O)C(=C(N3)O)C4=CC=CC=C4)Cl)O)C

InChI

InChI=1S/C21H16ClNO3S/c1-10-8-9-13(17(24)11(10)2)15-16-18(25)14(12-6-4-3-5-7-12)20(26)23-21(16)27-19(15)22/h3-9,24H,1-2H3,(H2,23,25,26)