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

Systemtic Name: 2-chloranyl-5-(3-methylsulfonylphenyl)-6-oxidanyl-3-phenyl-7H-thieno[2,3-b]pyridin-4-one Openeye Name: 2-chloro-6-hydroxy-5-(3-methylsulfonylphenyl)-3-phenyl-7H-thieno[2,3-b]pyridin-4-one CAS Name: 2-chloro-6-hydroxy-5-(3-methylsulfonylphenyl)-3-phenyl-7H-thieno[2,3-b]pyridin-4-one IUPAC Name: 2-chloro-6-hydroxy-5-(3-methylsulfonylphenyl)-3-phenyl-7H-thieno[2,3-b]pyridin-4-one Traditional Name: 2-chloro-6-hydroxy-5-(3-mesylphenyl)-3-phenyl-7H-thieno[2,3-b]pyridin-4-one Formula: C20H14ClNO4S2 MolecularWeight: 431.91246

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C2=C(NC3=C(C2=O)C(=C(S3)Cl)C4=CC=CC=C4)O

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C2=C(NC3=C(C2=O)C(=C(S3)Cl)C4=CC=CC=C4)O

InChI

InChI=1S/C20H14ClNO4S2/c1-28(25,26)13-9-5-8-12(10-13)15-17(23)16-14(11-6-3-2-4-7-11)18(21)27-20(16)22-19(15)24/h2-10H,1H3,(H2,22,23,24)