2-cyano-N-[(2S)-1-phenyl-3-pyrrolidin-1-yl-propan-2-yl]-4-(spiro[2.5]octan-6-ylmethylamino)pyrimidine-5-carboxamide

Systemtic Name: 2-cyano-N-[(2S)-1-phenyl-3-pyrrolidin-1-yl-propan-2-yl]-4-(spiro[2.5]octan-6-ylmethylamino)pyrimidine-5-carboxamide Openeye Name: N-[(1S)-1-benzyl-2-pyrrolidin-1-yl-ethyl]-2-cyano-4-(spiro[2.5]octan-6-ylmethylamino)pyrimidine-5-carboxamide CAS Name: 2-cyano-N-[(2S)-1-phenyl-3-(1-pyrrolidinyl)propan-2-yl]-4-(6-spiro[2.5]octanylmethylamino)-5-pyrimidinecarboxamide IUPAC Name: 2-cyano-N-[(2S)-1-phenyl-3-pyrrolidin-1-ylpropan-2-yl]-4-(spiro[2.5]octan-6-ylmethylamino)pyrimidine-5-carboxamide Traditional Name: N-[(1S)-1-benzyl-2-pyrrolidino-ethyl]-2-cyano-4-(spiro[2.5]octan-6-ylmethylamino)pyrimidine-5-carboxamide Formula: C28H36N6O MolecularWeight: 472.62504

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC(CC2=CC=CC=C2)NC(=O)C3=CN=C(N=C3NCC4CCC5(CC4)CC5)C#N

Isomeric SMILES

C1CCN(C1)C[C@H](CC2=CC=CC=C2)NC(=O)C3=CN=C(N=C3NCC4CCC5(CC4)CC5)C#N

InChI

InChI=1S/C28H36N6O/c29-17-25-30-19-24(26(33-25)31-18-22-8-10-28(11-9-22)12-13-28)27(35)32-23(20-34-14-4-5-15-34)16-21-6-2-1-3-7-21/h1-3,6-7,19,22-23H,4-5,8-16,18,20H2,(H,32,35)(H,30,31,33)/t23-/m0/s1