N'-[4-cyano-1-[(phenylmethyl)carbamoyl]piperidin-4-yl]-2,2-dimethyl-pentanediamide

Systemtic Name: N'-[4-cyano-1-[(phenylmethyl)carbamoyl]piperidin-4-yl]-2,2-dimethyl-pentanediamide Openeye Name: N'-[1-(benzylcarbamoyl)-4-cyano-4-piperidyl]-2,2-dimethyl-pentanediamide CAS Name: N'-[4-cyano-1-[oxo-[(phenylmethyl)amino]methyl]-4-piperidinyl]-2,2-dimethylpentanediamide IUPAC Name: N'-[1-(benzylcarbamoyl)-4-cyanopiperidin-4-yl]-2,2-dimethylpentanediamide Traditional Name: N'-[1-(benzylcarbamoyl)-4-cyano-4-piperidyl]-2,2-dimethyl-glutaramide Formula: C21H29N5O3 MolecularWeight: 399.48666

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCC(=O)NC1(CCN(CC1)C(=O)NCC2=CC=CC=C2)C#N)C(=O)N

Isomeric SMILES

CC(C)(CCC(=O)NC1(CCN(CC1)C(=O)NCC2=CC=CC=C2)C#N)C(=O)N

InChI

InChI=1S/C21H29N5O3/c1-20(2,18(23)28)9-8-17(27)25-21(15-22)10-12-26(13-11-21)19(29)24-14-16-6-4-3-5-7-16/h3-7H,8-14H2,1-2H3,(H2,23,28)(H,24,29)(H,25,27)