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

Systemtic Name: 2-cyano-N-[1-cyclopentyl-4-(phenylmethyl)piperidin-4-yl]-4-(spiro[2.5]octan-6-ylmethylamino)pyrimidine-5-carboxamide Openeye Name: N-(4-benzyl-1-cyclopentyl-4-piperidyl)-2-cyano-4-(spiro[2.5]octan-6-ylmethylamino)pyrimidine-5-carboxamide CAS Name: 2-cyano-N-[1-cyclopentyl-4-(phenylmethyl)-4-piperidinyl]-4-(6-spiro[2.5]octanylmethylamino)-5-pyrimidinecarboxamide IUPAC Name: N-(4-benzyl-1-cyclopentylpiperidin-4-yl)-2-cyano-4-(spiro[2.5]octan-6-ylmethylamino)pyrimidine-5-carboxamide Traditional Name: N-(4-benzyl-1-cyclopentyl-4-piperidyl)-2-cyano-4-(spiro[2.5]octan-6-ylmethylamino)pyrimidine-5-carboxamide Formula: C32H42N6O MolecularWeight: 526.71548

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2CCC(CC2)(CC3=CC=CC=C3)NC(=O)C4=CN=C(N=C4NCC5CCC6(CC5)CC6)C#N

Isomeric SMILES

C1CCC(C1)N2CCC(CC2)(CC3=CC=CC=C3)NC(=O)C4=CN=C(N=C4NCC5CCC6(CC5)CC6)C#N

InChI

InChI=1S/C32H42N6O/c33-21-28-34-23-27(29(36-28)35-22-25-10-12-31(13-11-25)14-15-31)30(39)37-32(20-24-6-2-1-3-7-24)16-18-38(19-17-32)26-8-4-5-9-26/h1-3,6-7,23,25-26H,4-5,8-20,22H2,(H,37,39)(H,34,35,36)