5-cyano-N,3-dimethyl-N-(phenylmethyl)-1-[2-(piperidin-4-ylamino)ethanoyl]-5-pyridin-2-yl-pyrrolidine-2-sulfonamide

Systemtic Name: 5-cyano-N,3-dimethyl-N-(phenylmethyl)-1-[2-(piperidin-4-ylamino)ethanoyl]-5-pyridin-2-yl-pyrrolidine-2-sulfonamide Openeye Name: N-benzyl-5-cyano-N,3-dimethyl-1-[2-(4-piperidylamino)acetyl]-5-(2-pyridyl)pyrrolidine-2-sulfonamide CAS Name: 5-cyano-N,3-dimethyl-1-[1-oxo-2-(4-piperidinylamino)ethyl]-N-(phenylmethyl)-5-(2-pyridinyl)-2-pyrrolidinesulfonamide IUPAC Name: N-benzyl-5-cyano-N,3-dimethyl-1-[2-(piperidin-4-ylamino)acetyl]-5-pyridin-2-ylpyrrolidine-2-sulfonamide Traditional Name: N-benzyl-5-cyano-N,3-dimethyl-1-[2-(4-piperidylamino)acetyl]-5-(2-pyridyl)pyrrolidine-2-sulfonamide Formula: C26H34N6O3S MolecularWeight: 510.65156

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(N(C1S(=O)(=O)N(C)CC2=CC=CC=C2)C(=O)CNC3CCNCC3)(C#N)C4=CC=CC=N4

Isomeric SMILES

CC1CC(N(C1S(=O)(=O)N(C)CC2=CC=CC=C2)C(=O)CNC3CCNCC3)(C#N)C4=CC=CC=N4

InChI

InChI=1S/C26H34N6O3S/c1-20-16-26(19-27,23-10-6-7-13-29-23)32(24(33)17-30-22-11-14-28-15-12-22)25(20)36(34,35)31(2)18-21-8-4-3-5-9-21/h3-10,13,20,22,25,28,30H,11-12,14-18H2,1-2H3