N-cyclopentyl-4-[3-[4-(cyclopentylamino)-3-(trifluoromethyl)phenyl]-5-piperidin-4-yl-1H-pyrazol-4-yl]pyrimidin-2-amine

Systemtic Name: N-cyclopentyl-4-[3-[4-(cyclopentylamino)-3-(trifluoromethyl)phenyl]-5-piperidin-4-yl-1H-pyrazol-4-yl]pyrimidin-2-amine Openeye Name: N-cyclopentyl-4-[3-[4-(cyclopentylamino)-3-(trifluoromethyl)phenyl]-5-(4-piperidyl)-1H-pyrazol-4-yl]pyrimidin-2-amine CAS Name: N-cyclopentyl-4-[3-[4-(cyclopentylamino)-3-(trifluoromethyl)phenyl]-5-(4-piperidinyl)-1H-pyrazol-4-yl]-2-pyrimidinamine IUPAC Name: N-cyclopentyl-4-[3-[4-(cyclopentylamino)-3-(trifluoromethyl)phenyl]-5-piperidin-4-yl-1H-pyrazol-4-yl]pyrimidin-2-amine Traditional Name: cyclopentyl-[4-[4-[2-(cyclopentylamino)pyrimidin-4-yl]-5-(4-piperidyl)-1H-pyrazol-3-yl]-2-(trifluoromethyl)phenyl]amine Formula: C29H36F3N7 MolecularWeight: 539.63825

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC2=C(C=C(C=C2)C3=NNC(=C3C4=NC(=NC=C4)NC5CCCC5)C6CCNCC6)C(F)(F)F

Isomeric SMILES

C1CCC(C1)NC2=C(C=C(C=C2)C3=NNC(=C3C4=NC(=NC=C4)NC5CCCC5)C6CCNCC6)C(F)(F)F

InChI

InChI=1S/C29H36F3N7/c30-29(31,32)22-17-19(9-10-23(22)35-20-5-1-2-6-20)27-25(26(38-39-27)18-11-14-33-15-12-18)24-13-16-34-28(37-24)36-21-7-3-4-8-21/h9-10,13,16-18,20-21,33,35H,1-8,11-12,14-15H2,(H,38,39)(H,34,36,37)