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

Systemtic Name: 3-tert-butyl-2-chloranyl-6-oxidanyl-5-(3-phenoxyphenyl)-7H-thieno[2,3-b]pyridin-4-one Openeye Name: 3-tert-butyl-2-chloro-6-hydroxy-5-(3-phenoxyphenyl)-7H-thieno[2,3-b]pyridin-4-one CAS Name: 3-tert-butyl-2-chloro-6-hydroxy-5-(3-phenoxyphenyl)-7H-thieno[2,3-b]pyridin-4-one IUPAC Name: 3-tert-butyl-2-chloro-6-hydroxy-5-(3-phenoxyphenyl)-7H-thieno[2,3-b]pyridin-4-one Traditional Name: 3-tert-butyl-2-chloro-6-hydroxy-5-(3-phenoxyphenyl)-7H-thieno[2,3-b]pyridin-4-one Formula: C23H20ClNO3S MolecularWeight: 425.9278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(SC2=C1C(=O)C(=C(N2)O)C3=CC(=CC=C3)OC4=CC=CC=C4)Cl

Isomeric SMILES

CC(C)(C)C1=C(SC2=C1C(=O)C(=C(N2)O)C3=CC(=CC=C3)OC4=CC=CC=C4)Cl

InChI

InChI=1S/C23H20ClNO3S/c1-23(2,3)18-17-19(26)16(21(27)25-22(17)29-20(18)24)13-8-7-11-15(12-13)28-14-9-5-4-6-10-14/h4-12H,1-3H3,(H2,25,26,27)