[1-[[3,5-bis(trifluoromethyl)phenyl]methyl]-5-[2-dimethylaminoethyl(methyl)amino]-1,2,3-triazol-4-yl]-[3-(2-chlorophenyl)-5-(hydroxymethyl)-1,2-oxazol-4-yl]methanone

Systemtic Name: [1-[[3,5-bis(trifluoromethyl)phenyl]methyl]-5-[2-dimethylaminoethyl(methyl)amino]-1,2,3-triazol-4-yl]-[3-(2-chlorophenyl)-5-(hydroxymethyl)-1,2-oxazol-4-yl]methanone Openeye Name: [1-[[3,5-bis(trifluoromethyl)phenyl]methyl]-5-[2-dimethylaminoethyl(methyl)amino]triazol-4-yl]-[3-(2-chlorophenyl)-5-(hydroxymethyl)isoxazol-4-yl]methanone CAS Name: [1-[[3,5-bis(trifluoromethyl)phenyl]methyl]-5-[2-dimethylaminoethyl(methyl)amino]-4-triazolyl]-[3-(2-chlorophenyl)-5-(hydroxymethyl)-4-isoxazolyl]methanone IUPAC Name: [1-[[3,5-bis(trifluoromethyl)phenyl]methyl]-5-[2-dimethylaminoethyl(methyl)amino]triazol-4-yl]-[3-(2-chlorophenyl)-5-(hydroxymethyl)-1,2-oxazol-4-yl]methanone Traditional Name: [1-[3,5-bis(trifluoromethyl)benzyl]-5-[2-dimethylaminoethyl(methyl)amino]triazol-4-yl]-[3-(2-chlorophenyl)-5-methylol-isoxazol-4-yl]methanone Formula: C27H25ClF6N6O3 MolecularWeight: 630.969219

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN(C)C1=C(N=NN1CC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C(=O)C3=C(ON=C3C4=CC=CC=C4Cl)CO

Isomeric SMILES

CN(C)CCN(C)C1=C(N=NN1CC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C(=O)C3=C(ON=C3C4=CC=CC=C4Cl)CO

InChI

InChI=1S/C27H25ClF6N6O3/c1-38(2)8-9-39(3)25-23(24(42)21-20(14-41)43-36-22(21)18-6-4-5-7-19(18)28)35-37-40(25)13-15-10-16(26(29,30)31)12-17(11-15)27(32,33)34/h4-7,10-12,41H,8-9,13-14H2,1-3H3