4-[[4-(3-azanylpropylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]benzamide

Systemtic Name: 4-[[4-(3-azanylpropylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]benzamide Openeye Name: 4-[[4-(3-aminopropylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]benzamide CAS Name: 4-[[4-(3-aminopropylamino)-5-(trifluoromethyl)-2-pyrimidinyl]amino]benzamide IUPAC Name: 4-[[4-(3-aminopropylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]benzamide Traditional Name: 4-[[4-(3-aminopropylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]benzamide Formula: C15H17F3N6O MolecularWeight: 354.33029

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)N)NC2=NC=C(C(=N2)NCCCN)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)N)NC2=NC=C(C(=N2)NCCCN)C(F)(F)F

InChI

InChI=1S/C15H17F3N6O/c16-15(17,18)11-8-22-14(24-13(11)21-7-1-6-19)23-10-4-2-9(3-5-10)12(20)25/h2-5,8H,1,6-7,19H2,(H2,20,25)(H2,21,22,23,24)