4-[[2-azanyl-5-(4-chloranylphenoxy)-6-(trifluoromethyl)pyrimidin-4-yl]amino]cyclohexan-1-ol

Systemtic Name: 4-[[2-azanyl-5-(4-chloranylphenoxy)-6-(trifluoromethyl)pyrimidin-4-yl]amino]cyclohexan-1-ol Openeye Name: 4-[[2-amino-5-(4-chlorophenoxy)-6-(trifluoromethyl)pyrimidin-4-yl]amino]cyclohexanol CAS Name: 4-[[2-amino-5-(4-chlorophenoxy)-6-(trifluoromethyl)-4-pyrimidinyl]amino]-1-cyclohexanol IUPAC Name: 4-[[2-amino-5-(4-chlorophenoxy)-6-(trifluoromethyl)pyrimidin-4-yl]amino]cyclohexan-1-ol Traditional Name: 4-[[2-amino-5-(4-chlorophenoxy)-6-(trifluoromethyl)pyrimidin-4-yl]amino]cyclohexanol Formula: C17H18ClF3N4O2 MolecularWeight: 402.79863

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NC2=NC(=NC(=C2OC3=CC=C(C=C3)Cl)C(F)(F)F)N)O

Isomeric SMILES

C1CC(CCC1NC2=NC(=NC(=C2OC3=CC=C(C=C3)Cl)C(F)(F)F)N)O

InChI

InChI=1S/C17H18ClF3N4O2/c18-9-1-7-12(8-2-9)27-13-14(17(19,20)21)24-16(22)25-15(13)23-10-3-5-11(26)6-4-10/h1-2,7-8,10-11,26H,3-6H2,(H3,22,23,24,25)