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

Systemtic Name: 2-chloranyl-6-oxidanyl-5-(3-phenoxyphenyl)-3-propyl-7H-thieno[2,3-b]pyridin-4-one Openeye Name: 2-chloro-6-hydroxy-5-(3-phenoxyphenyl)-3-propyl-7H-thieno[2,3-b]pyridin-4-one CAS Name: 2-chloro-6-hydroxy-5-(3-phenoxyphenyl)-3-propyl-7H-thieno[2,3-b]pyridin-4-one IUPAC Name: 2-chloro-6-hydroxy-5-(3-phenoxyphenyl)-3-propyl-7H-thieno[2,3-b]pyridin-4-one Traditional Name: 2-chloro-6-hydroxy-5-(3-phenoxyphenyl)-3-propyl-7H-thieno[2,3-b]pyridin-4-one Formula: C22H18ClNO3S MolecularWeight: 411.90122

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(SC2=C1C(=O)C(=C(N2)O)C3=CC(=CC=C3)OC4=CC=CC=C4)Cl

Isomeric SMILES

CCCC1=C(SC2=C1C(=O)C(=C(N2)O)C3=CC(=CC=C3)OC4=CC=CC=C4)Cl

InChI

InChI=1S/C22H18ClNO3S/c1-2-7-16-18-19(25)17(21(26)24-22(18)28-20(16)23)13-8-6-11-15(12-13)27-14-9-4-3-5-10-14/h3-6,8-12H,2,7H2,1H3,(H2,24,25,26)