(2S)-N-[(4-azanylcyclohexyl)methyl]-1-[(2R,3S)-1-methyl-5-oxidanylidene-3-pyridin-3-yl-pyrrolidin-2-yl]carbonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[(4-azanylcyclohexyl)methyl]-1-[(2R,3S)-1-methyl-5-oxidanylidene-3-pyridin-3-yl-pyrrolidin-2-yl]carbonyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[(4-aminocyclohexyl)methyl]-1-[(2R,3S)-1-methyl-5-oxo-3-(3-pyridyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide CAS Name: (2S)-N-[(4-aminocyclohexyl)methyl]-1-[[(2R,3S)-1-methyl-5-oxo-3-(3-pyridinyl)-2-pyrrolidinyl]-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-[(4-aminocyclohexyl)methyl]-1-[(2R,3S)-1-methyl-5-oxo-3-pyridin-3-ylpyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide Traditional Name: (2S)-N-[(4-aminocyclohexyl)methyl]-1-[(2R,3S)-5-keto-1-methyl-3-(3-pyridyl)prolyl]pyrrolidine-2-carboxamide Formula: C23H33N5O3 MolecularWeight: 427.53982

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C(CC1=O)C2=CN=CC=C2)C(=O)N3CCCC3C(=O)NCC4CCC(CC4)N

Isomeric SMILES

CN1[C@H]([C@@H](CC1=O)C2=CN=CC=C2)C(=O)N3CCC[C@H]3C(=O)NCC4CCC(CC4)N

InChI

InChI=1S/C23H33N5O3/c1-27-20(29)12-18(16-4-2-10-25-14-16)21(27)23(31)28-11-3-5-19(28)22(30)26-13-15-6-8-17(24)9-7-15/h2,4,10,14-15,17-19,21H,3,5-9,11-13,24H2,1H3,(H,26,30)/t15?,17?,18-,19-,21+/m0/s1