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

Systemtic Name: N-(3-chlorophenyl)-5-[(3-phenylpropylamino)methyl]-4-(trifluoromethyl)pyrimidin-2-amine Openeye Name: N-(3-chlorophenyl)-5-[(3-phenylpropylamino)methyl]-4-(trifluoromethyl)pyrimidin-2-amine CAS Name: N-(3-chlorophenyl)-5-[(3-phenylpropylamino)methyl]-4-(trifluoromethyl)-2-pyrimidinamine IUPAC Name: N-(3-chlorophenyl)-5-[(3-phenylpropylamino)methyl]-4-(trifluoromethyl)pyrimidin-2-amine Traditional Name: [2-(3-chloroanilino)-4-(trifluoromethyl)pyrimidin-5-yl]methyl-(3-phenylpropyl)amine Formula: C21H20ClF3N4 MolecularWeight: 420.85851

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCNCC2=CN=C(N=C2C(F)(F)F)NC3=CC(=CC=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)CCCNCC2=CN=C(N=C2C(F)(F)F)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H20ClF3N4/c22-17-9-4-10-18(12-17)28-20-27-14-16(19(29-20)21(23,24)25)13-26-11-5-8-15-6-2-1-3-7-15/h1-4,6-7,9-10,12,14,26H,5,8,11,13H2,(H,27,28,29)