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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC2=C1C(=O)C(=C(N2)O)C3=CC(=CC=C3)OC4=CC=CC=C4)Cl

Isomeric SMILES

CCC1=C(SC2=C1C(=O)C(=C(N2)O)C3=CC(=CC=C3)OC4=CC=CC=C4)Cl

InChI

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