5-tert-butyl-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-2-(phenylmethyl)pyrazole-3-carboxamide

Systemtic Name: 5-tert-butyl-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-2-(phenylmethyl)pyrazole-3-carboxamide Openeye Name: 2-benzyl-5-tert-butyl-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]pyrazole-3-carboxamide CAS Name: 5-tert-butyl-N-[4-[[4-(dimethylamino)-2-pyrimidinyl]amino]cyclohexyl]-2-(phenylmethyl)-3-pyrazolecarboxamide IUPAC Name: 2-benzyl-5-tert-butyl-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]pyrazole-3-carboxamide Traditional Name: 2-benzyl-5-tert-butyl-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]pyrazole-3-carboxamide Formula: C27H37N7O MolecularWeight: 475.62898

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)C(=O)NC2CCC(CC2)NC3=NC=CC(=N3)N(C)C)CC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)C(=O)NC2CCC(CC2)NC3=NC=CC(=N3)N(C)C)CC4=CC=CC=C4

InChI

InChI=1S/C27H37N7O/c1-27(2,3)23-17-22(34(32-23)18-19-9-7-6-8-10-19)25(35)29-20-11-13-21(14-12-20)30-26-28-16-15-24(31-26)33(4)5/h6-10,15-17,20-21H,11-14,18H2,1-5H3,(H,29,35)(H,28,30,31)