2-chloranyl-3-[4-[(1-cyclopropyl-4-oxidanyl-piperidin-4-yl)methoxy]phenyl]-6-oxidanyl-4-oxidanylidene-7H-thieno[2,3-b]pyridine-5-carbonitrile

Systemtic Name: 2-chloranyl-3-[4-[(1-cyclopropyl-4-oxidanyl-piperidin-4-yl)methoxy]phenyl]-6-oxidanyl-4-oxidanylidene-7H-thieno[2,3-b]pyridine-5-carbonitrile Openeye Name: 2-chloro-3-[4-[(1-cyclopropyl-4-hydroxy-4-piperidyl)methoxy]phenyl]-6-hydroxy-4-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrile CAS Name: 2-chloro-3-[4-[(1-cyclopropyl-4-hydroxy-4-piperidinyl)methoxy]phenyl]-6-hydroxy-4-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrile IUPAC Name: 2-chloro-3-[4-[(1-cyclopropyl-4-hydroxypiperidin-4-yl)methoxy]phenyl]-6-hydroxy-4-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrile Traditional Name: 2-chloro-3-[4-[(1-cyclopropyl-4-hydroxy-4-piperidyl)methoxy]phenyl]-6-hydroxy-4-keto-7H-thieno[2,3-b]pyridine-5-carbonitrile Formula: C23H22ClN3O4S MolecularWeight: 471.95648

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2CCC(CC2)(COC3=CC=C(C=C3)C4=C(SC5=C4C(=O)C(=C(N5)O)C#N)Cl)O

Isomeric SMILES

C1CC1N2CCC(CC2)(COC3=CC=C(C=C3)C4=C(SC5=C4C(=O)C(=C(N5)O)C#N)Cl)O

InChI

InChI=1S/C23H22ClN3O4S/c24-20-17(18-19(28)16(11-25)21(29)26-22(18)32-20)13-1-5-15(6-2-13)31-12-23(30)7-9-27(10-8-23)14-3-4-14/h1-2,5-6,14,30H,3-4,7-10,12H2,(H2,26,28,29)