N-(3-chlorophenyl)-5-[(oxolan-2-ylmethylamino)methyl]-4-(trifluoromethyl)pyrimidin-2-amine

Systemtic Name: N-(3-chlorophenyl)-5-[(oxolan-2-ylmethylamino)methyl]-4-(trifluoromethyl)pyrimidin-2-amine Openeye Name: N-(3-chlorophenyl)-5-[(tetrahydrofuran-2-ylmethylamino)methyl]-4-(trifluoromethyl)pyrimidin-2-amine CAS Name: N-(3-chlorophenyl)-5-[(2-oxolanylmethylamino)methyl]-4-(trifluoromethyl)-2-pyrimidinamine IUPAC Name: N-(3-chlorophenyl)-5-[(oxolan-2-ylmethylamino)methyl]-4-(trifluoromethyl)pyrimidin-2-amine Traditional Name: [2-(3-chloroanilino)-4-(trifluoromethyl)pyrimidin-5-yl]methyl-(tetrahydrofurfuryl)amine Formula: C17H18ClF3N4O MolecularWeight: 386.79923

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNCC2=CN=C(N=C2C(F)(F)F)NC3=CC(=CC=C3)Cl

Isomeric SMILES

C1CC(OC1)CNCC2=CN=C(N=C2C(F)(F)F)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C17H18ClF3N4O/c18-12-3-1-4-13(7-12)24-16-23-9-11(15(25-16)17(19,20)21)8-22-10-14-5-2-6-26-14/h1,3-4,7,9,14,22H,2,5-6,8,10H2,(H,23,24,25)