2-chloranyl-6-oxidanyl-4-oxidanylidene-3-[4-[(4-oxidanylpiperidin-4-yl)methoxy]phenyl]-7H-thieno[2,3-b]pyridine-5-carbonitrile

Systemtic Name: 2-chloranyl-6-oxidanyl-4-oxidanylidene-3-[4-[(4-oxidanylpiperidin-4-yl)methoxy]phenyl]-7H-thieno[2,3-b]pyridine-5-carbonitrile Openeye Name: 2-chloro-6-hydroxy-3-[4-[(4-hydroxy-4-piperidyl)methoxy]phenyl]-4-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrile CAS Name: 2-chloro-6-hydroxy-3-[4-[(4-hydroxy-4-piperidinyl)methoxy]phenyl]-4-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrile IUPAC Name: 2-chloro-6-hydroxy-3-[4-[(4-hydroxypiperidin-4-yl)methoxy]phenyl]-4-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrile Traditional Name: 2-chloro-6-hydroxy-3-[4-[(4-hydroxy-4-piperidyl)methoxy]phenyl]-4-keto-7H-thieno[2,3-b]pyridine-5-carbonitrile Formula: C20H18ClN3O4S MolecularWeight: 431.89262

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1(COC2=CC=C(C=C2)C3=C(SC4=C3C(=O)C(=C(N4)O)C#N)Cl)O

Isomeric SMILES

C1CNCCC1(COC2=CC=C(C=C2)C3=C(SC4=C3C(=O)C(=C(N4)O)C#N)Cl)O

InChI

InChI=1S/C20H18ClN3O4S/c21-17-14(15-16(25)13(9-22)18(26)24-19(15)29-17)11-1-3-12(4-2-11)28-10-20(27)5-7-23-8-6-20/h1-4,23,27H,5-8,10H2,(H2,24,25,26)