1-[1-[6-methoxy-5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl]-3-(1-methylisoquinolin-5-yl)urea

Systemtic Name: 1-[1-[6-methoxy-5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl]-3-(1-methylisoquinolin-5-yl)urea Openeye Name: 1-[1-[6-methoxy-5-(trifluoromethyl)-2-pyridyl]-4-piperidyl]-3-(1-methyl-5-isoquinolyl)urea CAS Name: 1-[1-[6-methoxy-5-(trifluoromethyl)-2-pyridinyl]-4-piperidinyl]-3-(1-methyl-5-isoquinolinyl)urea IUPAC Name: 1-[1-[6-methoxy-5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl]-3-(1-methylisoquinolin-5-yl)urea Traditional Name: 1-[1-[6-methoxy-5-(trifluoromethyl)-2-pyridyl]-4-piperidyl]-3-(1-methyl-5-isoquinolyl)urea Formula: C23H24F3N5O2 MolecularWeight: 459.46417

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC2=C1C=CC=C2NC(=O)NC3CCN(CC3)C4=NC(=C(C=C4)C(F)(F)F)OC

Isomeric SMILES

CC1=NC=CC2=C1C=CC=C2NC(=O)NC3CCN(CC3)C4=NC(=C(C=C4)C(F)(F)F)OC

InChI

InChI=1S/C23H24F3N5O2/c1-14-16-4-3-5-19(17(16)8-11-27-14)29-22(32)28-15-9-12-31(13-10-15)20-7-6-18(23(24,25)26)21(30-20)33-2/h3-8,11,15H,9-10,12-13H2,1-2H3,(H2,28,29,32)