1-[3-[(4-cyano-1-pyridin-4-ylcarbonyl-piperidin-4-yl)amino]-3-oxidanylidene-propyl]cyclohexane-1-carboxamide

Systemtic Name: 1-[3-[(4-cyano-1-pyridin-4-ylcarbonyl-piperidin-4-yl)amino]-3-oxidanylidene-propyl]cyclohexane-1-carboxamide Openeye Name: 1-[3-[[4-cyano-1-(pyridine-4-carbonyl)-4-piperidyl]amino]-3-oxo-propyl]cyclohexanecarboxamide CAS Name: 1-[3-[[4-cyano-1-[oxo(pyridin-4-yl)methyl]-4-piperidinyl]amino]-3-oxopropyl]-1-cyclohexanecarboxamide IUPAC Name: 1-[3-[[4-cyano-1-(pyridine-4-carbonyl)piperidin-4-yl]amino]-3-oxopropyl]cyclohexane-1-carboxamide Traditional Name: 1-[3-[(4-cyano-1-isonicotinoyl-4-piperidyl)amino]-3-keto-propyl]cyclohexanecarboxamide Formula: C22H29N5O3 MolecularWeight: 411.49736

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CCC(=O)NC2(CCN(CC2)C(=O)C3=CC=NC=C3)C#N)C(=O)N

Isomeric SMILES

C1CCC(CC1)(CCC(=O)NC2(CCN(CC2)C(=O)C3=CC=NC=C3)C#N)C(=O)N

InChI

InChI=1S/C22H29N5O3/c23-16-22(10-14-27(15-11-22)19(29)17-5-12-25-13-6-17)26-18(28)4-9-21(20(24)30)7-2-1-3-8-21/h5-6,12-13H,1-4,7-11,14-15H2,(H2,24,30)(H,26,28)