(2S)-N-[(2R)-1-[(6-azanylpyridin-3-yl)methylamino]-3,3-dicyclohexyl-1-oxidanylidene-propan-2-yl]-1-methyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[(2R)-1-[(6-azanylpyridin-3-yl)methylamino]-3,3-dicyclohexyl-1-oxidanylidene-propan-2-yl]-1-methyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[(1R)-1-[(6-amino-3-pyridyl)methylcarbamoyl]-2,2-dicyclohexyl-ethyl]-1-methyl-pyrrolidine-2-carboxamide CAS Name: (2S)-N-[(2R)-1-[(6-amino-3-pyridinyl)methylamino]-3,3-dicyclohexyl-1-oxopropan-2-yl]-1-methyl-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-[(2R)-1-[(6-aminopyridin-3-yl)methylamino]-3,3-dicyclohexyl-1-oxopropan-2-yl]-1-methylpyrrolidine-2-carboxamide Traditional Name: (2S)-N-[(1R)-1-[(6-amino-3-pyridyl)methylcarbamoyl]-2,2-dicyclohexyl-ethyl]-1-methyl-pyrrolidine-2-carboxamide Formula: C27H43N5O2 MolecularWeight: 469.66262

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC1C(=O)NC(C(C2CCCCC2)C3CCCCC3)C(=O)NCC4=CN=C(C=C4)N

Isomeric SMILES

CN1CCC[C@H]1C(=O)N[C@H](C(C2CCCCC2)C3CCCCC3)C(=O)NCC4=CN=C(C=C4)N

InChI

InChI=1S/C27H43N5O2/c1-32-16-8-13-22(32)26(33)31-25(27(34)30-18-19-14-15-23(28)29-17-19)24(20-9-4-2-5-10-20)21-11-6-3-7-12-21/h14-15,17,20-22,24-25H,2-13,16,18H2,1H3,(H2,28,29)(H,30,34)(H,31,33)/t22-,25+/m0/s1