N-[4-methyl-3-[(1-pyrimidin-4-ylbenzimidazol-2-yl)amino]phenyl]-3-piperidin-4-yloxy-5-(trifluoromethyl)benzamide

Systemtic Name: N-[4-methyl-3-[(1-pyrimidin-4-ylbenzimidazol-2-yl)amino]phenyl]-3-piperidin-4-yloxy-5-(trifluoromethyl)benzamide Openeye Name: N-[4-methyl-3-[(1-pyrimidin-4-ylbenzimidazol-2-yl)amino]phenyl]-3-(4-piperidyloxy)-5-(trifluoromethyl)benzamide CAS Name: N-[4-methyl-3-[[1-(4-pyrimidinyl)-2-benzimidazolyl]amino]phenyl]-3-(4-piperidinyloxy)-5-(trifluoromethyl)benzamide IUPAC Name: N-[4-methyl-3-[(1-pyrimidin-4-ylbenzimidazol-2-yl)amino]phenyl]-3-piperidin-4-yloxy-5-(trifluoromethyl)benzamide Traditional Name: N-[4-methyl-3-[[1-(4-pyrimidyl)benzimidazol-2-yl]amino]phenyl]-3-(4-piperidyloxy)-5-(trifluoromethyl)benzamide Formula: C31H28F3N7O2 MolecularWeight: 587.59493

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC(=C2)OC3CCNCC3)C(F)(F)F)NC4=NC5=CC=CC=C5N4C6=NC=NC=C6

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC(=C2)OC3CCNCC3)C(F)(F)F)NC4=NC5=CC=CC=C5N4C6=NC=NC=C6

InChI

InChI=1S/C31H28F3N7O2/c1-19-6-7-22(17-26(19)40-30-39-25-4-2-3-5-27(25)41(30)28-10-13-36-18-37-28)38-29(42)20-14-21(31(32,33)34)16-24(15-20)43-23-8-11-35-12-9-23/h2-7,10,13-18,23,35H,8-9,11-12H2,1H3,(H,38,42)(H,39,40)