N-[1-[[3-cyano-1-(phenylmethyl)pyrrolidin-3-yl]amino]-3-cyclohexyl-1-oxidanylidene-propan-2-yl]pyrrolidine-1-carboxamide

Systemtic Name: N-[1-[[3-cyano-1-(phenylmethyl)pyrrolidin-3-yl]amino]-3-cyclohexyl-1-oxidanylidene-propan-2-yl]pyrrolidine-1-carboxamide Openeye Name: N-[2-[(1-benzyl-3-cyano-pyrrolidin-3-yl)amino]-1-(cyclohexylmethyl)-2-oxo-ethyl]pyrrolidine-1-carboxamide CAS Name: N-[1-[[3-cyano-1-(phenylmethyl)-3-pyrrolidinyl]amino]-3-cyclohexyl-1-oxopropan-2-yl]-1-pyrrolidinecarboxamide IUPAC Name: N-[1-[(1-benzyl-3-cyanopyrrolidin-3-yl)amino]-3-cyclohexyl-1-oxopropan-2-yl]pyrrolidine-1-carboxamide Traditional Name: N-[2-[(1-benzyl-3-cyano-pyrrolidin-3-yl)amino]-1-(cyclohexylmethyl)-2-keto-ethyl]pyrrolidine-1-carboxamide Formula: C26H37N5O2 MolecularWeight: 451.60428

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(=O)NC2(CCN(C2)CC3=CC=CC=C3)C#N)NC(=O)N4CCCC4

Isomeric SMILES

C1CCC(CC1)CC(C(=O)NC2(CCN(C2)CC3=CC=CC=C3)C#N)NC(=O)N4CCCC4

InChI

InChI=1S/C26H37N5O2/c27-19-26(13-16-30(20-26)18-22-11-5-2-6-12-22)29-24(32)23(17-21-9-3-1-4-10-21)28-25(33)31-14-7-8-15-31/h2,5-6,11-12,21,23H,1,3-4,7-10,13-18,20H2,(H,28,33)(H,29,32)