N-[[2-cyano-4-(2,2-dimethylpropylamino)pyrimidin-5-yl]methyl]-4-(1-propylpiperidin-4-yl)benzamide

Systemtic Name: N-[[2-cyano-4-(2,2-dimethylpropylamino)pyrimidin-5-yl]methyl]-4-(1-propylpiperidin-4-yl)benzamide Openeye Name: N-[[2-cyano-4-(2,2-dimethylpropylamino)pyrimidin-5-yl]methyl]-4-(1-propyl-4-piperidyl)benzamide CAS Name: N-[[2-cyano-4-(2,2-dimethylpropylamino)-5-pyrimidinyl]methyl]-4-(1-propyl-4-piperidinyl)benzamide IUPAC Name: N-[[2-cyano-4-(2,2-dimethylpropylamino)pyrimidin-5-yl]methyl]-4-(1-propylpiperidin-4-yl)benzamide Traditional Name: N-[[2-cyano-4-(neopentylamino)pyrimidin-5-yl]methyl]-4-(1-propyl-4-piperidyl)benzamide Formula: C26H36N6O MolecularWeight: 448.60364

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCC(CC1)C2=CC=C(C=C2)C(=O)NCC3=CN=C(N=C3NCC(C)(C)C)C#N

Isomeric SMILES

CCCN1CCC(CC1)C2=CC=C(C=C2)C(=O)NCC3=CN=C(N=C3NCC(C)(C)C)C#N

InChI

InChI=1S/C26H36N6O/c1-5-12-32-13-10-20(11-14-32)19-6-8-21(9-7-19)25(33)29-17-22-16-28-23(15-27)31-24(22)30-18-26(2,3)4/h6-9,16,20H,5,10-14,17-18H2,1-4H3,(H,29,33)(H,28,30,31)