3-[[2,4-bis(trifluoromethyl)phenyl]methyl-(5-ethylpyrimidin-2-yl)amino]propan-1-ol

Systemtic Name: 3-[[2,4-bis(trifluoromethyl)phenyl]methyl-(5-ethylpyrimidin-2-yl)amino]propan-1-ol Openeye Name: 3-[[2,4-bis(trifluoromethyl)phenyl]methyl-(5-ethylpyrimidin-2-yl)amino]propan-1-ol CAS Name: 3-[[2,4-bis(trifluoromethyl)phenyl]methyl-(5-ethyl-2-pyrimidinyl)amino]-1-propanol IUPAC Name: 3-[[2,4-bis(trifluoromethyl)phenyl]methyl-(5-ethylpyrimidin-2-yl)amino]propan-1-ol Traditional Name: 3-[[2,4-bis(trifluoromethyl)benzyl]-(5-ethylpyrimidin-2-yl)amino]propan-1-ol Formula: C18H19F6N3O MolecularWeight: 407.353379

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(N=C1)N(CCCO)CC2=C(C=C(C=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CCC1=CN=C(N=C1)N(CCCO)CC2=C(C=C(C=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C18H19F6N3O/c1-2-12-9-25-16(26-10-12)27(6-3-7-28)11-13-4-5-14(17(19,20)21)8-15(13)18(22,23)24/h4-5,8-10,28H,2-3,6-7,11H2,1H3