2-cyano-4-(1-methylpiperidin-4-yl)oxy-N-(phenylmethyl)-6-(spiro[2.5]octan-6-ylmethylamino)pyrimidine-5-carboxamide

Systemtic Name: 2-cyano-4-(1-methylpiperidin-4-yl)oxy-N-(phenylmethyl)-6-(spiro[2.5]octan-6-ylmethylamino)pyrimidine-5-carboxamide Openeye Name: N-benzyl-2-cyano-4-[(1-methyl-4-piperidyl)oxy]-6-(spiro[2.5]octan-6-ylmethylamino)pyrimidine-5-carboxamide CAS Name: 2-cyano-4-[(1-methyl-4-piperidinyl)oxy]-N-(phenylmethyl)-6-(6-spiro[2.5]octanylmethylamino)-5-pyrimidinecarboxamide IUPAC Name: N-benzyl-2-cyano-4-(1-methylpiperidin-4-yl)oxy-6-(spiro[2.5]octan-6-ylmethylamino)pyrimidine-5-carboxamide Traditional Name: N-benzyl-2-cyano-4-[(1-methyl-4-piperidyl)oxy]-6-(spiro[2.5]octan-6-ylmethylamino)pyrimidine-5-carboxamide Formula: C28H36N6O2 MolecularWeight: 488.62444

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)OC2=NC(=NC(=C2C(=O)NCC3=CC=CC=C3)NCC4CCC5(CC4)CC5)C#N

Isomeric SMILES

CN1CCC(CC1)OC2=NC(=NC(=C2C(=O)NCC3=CC=CC=C3)NCC4CCC5(CC4)CC5)C#N

InChI

InChI=1S/C28H36N6O2/c1-34-15-9-22(10-16-34)36-27-24(26(35)31-19-20-5-3-2-4-6-20)25(32-23(17-29)33-27)30-18-21-7-11-28(12-8-21)13-14-28/h2-6,21-22H,7-16,18-19H2,1H3,(H,31,35)(H,30,32,33)