2-chloranyl-3-[4-[(1-cyclopentyl-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-cyclopentyl-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-cyclopentyl-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-cyclopentyl-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-cyclopentyl-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-cyclopentyl-4-hydroxy-4-piperidyl)methoxy]phenyl]-6-hydroxy-4-keto-7H-thieno[2,3-b]pyridine-5-carbonitrile Formula: C25H26ClN3O4S MolecularWeight: 500.00964

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2CCC(CC2)(COC3=CC=C(C=C3)C4=C(SC5=C4C(=O)C(=C(N5)O)C#N)Cl)O

Isomeric SMILES

C1CCC(C1)N2CCC(CC2)(COC3=CC=C(C=C3)C4=C(SC5=C4C(=O)C(=C(N5)O)C#N)Cl)O

InChI

InChI=1S/C25H26ClN3O4S/c26-22-19(20-21(30)18(13-27)23(31)28-24(20)34-22)15-5-7-17(8-6-15)33-14-25(32)9-11-29(12-10-25)16-3-1-2-4-16/h5-8,16,32H,1-4,9-12,14H2,(H2,28,30,31)