3-[3-(1,3-benzodioxol-5-yl)phenyl]-6-oxidanyl-5-phenyl-7H-thieno[2,3-b]pyridin-4-one

Systemtic Name: 3-[3-(1,3-benzodioxol-5-yl)phenyl]-6-oxidanyl-5-phenyl-7H-thieno[2,3-b]pyridin-4-one Openeye Name: 3-[3-(1,3-benzodioxol-5-yl)phenyl]-6-hydroxy-5-phenyl-7H-thieno[2,3-b]pyridin-4-one CAS Name: 3-[3-(1,3-benzodioxol-5-yl)phenyl]-6-hydroxy-5-phenyl-7H-thieno[2,3-b]pyridin-4-one IUPAC Name: 3-[3-(1,3-benzodioxol-5-yl)phenyl]-6-hydroxy-5-phenyl-7H-thieno[2,3-b]pyridin-4-one Traditional Name: 3-[3-(1,3-benzodioxol-5-yl)phenyl]-6-hydroxy-5-phenyl-7H-thieno[2,3-b]pyridin-4-one Formula: C26H17NO4S MolecularWeight: 439.48248

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CC(=CC=C3)C4=CSC5=C4C(=O)C(=C(N5)O)C6=CC=CC=C6

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CC(=CC=C3)C4=CSC5=C4C(=O)C(=C(N5)O)C6=CC=CC=C6

InChI

InChI=1S/C26H17NO4S/c28-24-22(15-5-2-1-3-6-15)25(29)27-26-23(24)19(13-32-26)18-8-4-7-16(11-18)17-9-10-20-21(12-17)31-14-30-20/h1-13H,14H2,(H2,27,28,29)