4-(1,3-benzodioxol-5-yl)-N-cyclohexyl-6-(trifluoromethyl)pyrimidin-2-amine

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-N-cyclohexyl-6-(trifluoromethyl)pyrimidin-2-amine Openeye Name: 4-(1,3-benzodioxol-5-yl)-N-cyclohexyl-6-(trifluoromethyl)pyrimidin-2-amine CAS Name: 4-(1,3-benzodioxol-5-yl)-N-cyclohexyl-6-(trifluoromethyl)-2-pyrimidinamine IUPAC Name: 4-(1,3-benzodioxol-5-yl)-N-cyclohexyl-6-(trifluoromethyl)pyrimidin-2-amine Traditional Name: [4-(1,3-benzodioxol-5-yl)-6-(trifluoromethyl)pyrimidin-2-yl]-cyclohexyl-amine Formula: C18H18F3N3O2 MolecularWeight: 365.34963

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=NC(=CC(=N2)C(F)(F)F)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCC(CC1)NC2=NC(=CC(=N2)C(F)(F)F)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H18F3N3O2/c19-18(20,21)16-9-13(11-6-7-14-15(8-11)26-10-25-14)23-17(24-16)22-12-4-2-1-3-5-12/h6-9,12H,1-5,10H2,(H,22,23,24)