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

Systemtic Name: 1-(1-methylisoquinolin-5-yl)-3-[1-[3-methyl-5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl]urea Openeye Name: 1-(1-methyl-5-isoquinolyl)-3-[1-[3-methyl-5-(trifluoromethyl)-2-pyridyl]-4-piperidyl]urea CAS Name: 1-(1-methyl-5-isoquinolinyl)-3-[1-[3-methyl-5-(trifluoromethyl)-2-pyridinyl]-4-piperidinyl]urea IUPAC Name: 1-(1-methylisoquinolin-5-yl)-3-[1-[3-methyl-5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl]urea Traditional Name: 1-(1-methyl-5-isoquinolyl)-3-[1-[3-methyl-5-(trifluoromethyl)-2-pyridyl]-4-piperidyl]urea Formula: C23H24F3N5O MolecularWeight: 443.46477

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC(=C1)C(F)(F)F)N2CCC(CC2)NC(=O)NC3=CC=CC4=C3C=CN=C4C

Isomeric SMILES

CC1=C(N=CC(=C1)C(F)(F)F)N2CCC(CC2)NC(=O)NC3=CC=CC4=C3C=CN=C4C

InChI

InChI=1S/C23H24F3N5O/c1-14-12-16(23(24,25)26)13-28-21(14)31-10-7-17(8-11-31)29-22(32)30-20-5-3-4-18-15(2)27-9-6-19(18)20/h3-6,9,12-13,17H,7-8,10-11H2,1-2H3,(H2,29,30,32)