N-[3-[[(6-azanylpyrimidin-4-yl)-cyclopentyl-carbamoyl]amino]-4-methyl-phenyl]-3-(trifluoromethyl)benzamide

Systemtic Name: N-[3-[[(6-azanylpyrimidin-4-yl)-cyclopentyl-carbamoyl]amino]-4-methyl-phenyl]-3-(trifluoromethyl)benzamide Openeye Name: N-[3-[[(6-aminopyrimidin-4-yl)-cyclopentyl-carbamoyl]amino]-4-methyl-phenyl]-3-(trifluoromethyl)benzamide CAS Name: N-[3-[[[(6-amino-4-pyrimidinyl)-cyclopentylamino]-oxomethyl]amino]-4-methylphenyl]-3-(trifluoromethyl)benzamide IUPAC Name: N-[3-[[(6-aminopyrimidin-4-yl)-cyclopentylcarbamoyl]amino]-4-methylphenyl]-3-(trifluoromethyl)benzamide Traditional Name: N-[3-[[(6-aminopyrimidin-4-yl)-cyclopentyl-carbamoyl]amino]-4-methyl-phenyl]-3-(trifluoromethyl)benzamide Formula: C25H25F3N6O2 MolecularWeight: 498.50021

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)C(F)(F)F)NC(=O)N(C3CCCC3)C4=NC=NC(=C4)N

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)C(F)(F)F)NC(=O)N(C3CCCC3)C4=NC=NC(=C4)N

InChI

InChI=1S/C25H25F3N6O2/c1-15-9-10-18(32-23(35)16-5-4-6-17(11-16)25(26,27)28)12-20(15)33-24(36)34(19-7-2-3-8-19)22-13-21(29)30-14-31-22/h4-6,9-14,19H,2-3,7-8H2,1H3,(H,32,35)(H,33,36)(H2,29,30,31)