N-(3-chlorophenyl)-5-[(oxan-4-ylamino)methyl]-4-(trifluoromethyl)pyrimidin-2-amine

Systemtic Name: N-(3-chlorophenyl)-5-[(oxan-4-ylamino)methyl]-4-(trifluoromethyl)pyrimidin-2-amine Openeye Name: N-(3-chlorophenyl)-5-[(tetrahydropyran-4-ylamino)methyl]-4-(trifluoromethyl)pyrimidin-2-amine CAS Name: N-(3-chlorophenyl)-5-[(4-oxanylamino)methyl]-4-(trifluoromethyl)-2-pyrimidinamine IUPAC Name: N-(3-chlorophenyl)-5-[(oxan-4-ylamino)methyl]-4-(trifluoromethyl)pyrimidin-2-amine Traditional Name: [2-(3-chloroanilino)-4-(trifluoromethyl)pyrimidin-5-yl]methyl-tetrahydropyran-4-yl-amine Formula: C17H18ClF3N4O MolecularWeight: 386.79923

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1NCC2=CN=C(N=C2C(F)(F)F)NC3=CC(=CC=C3)Cl

Isomeric SMILES

C1COCCC1NCC2=CN=C(N=C2C(F)(F)F)NC3=CC(=CC=C3)Cl

InChI

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