2-[4-methyl-6-(phenethylamino)pyrimidin-2-yl]-1-[4-(trifluoromethyl)phenyl]guanidine

Systemtic Name: 2-[4-methyl-6-(phenethylamino)pyrimidin-2-yl]-1-[4-(trifluoromethyl)phenyl]guanidine Openeye Name: 2-[4-methyl-6-(phenethylamino)pyrimidin-2-yl]-1-[4-(trifluoromethyl)phenyl]guanidine CAS Name: 2-[4-methyl-6-(phenethylamino)-2-pyrimidinyl]-1-[4-(trifluoromethyl)phenyl]guanidine IUPAC Name: 2-[4-methyl-6-(phenethylamino)pyrimidin-2-yl]-1-[4-(trifluoromethyl)phenyl]guanidine Traditional Name: 2-[4-methyl-6-(phenethylamino)pyrimidin-2-yl]-1-[4-(trifluoromethyl)phenyl]guanidine Formula: C21H21F3N6 MolecularWeight: 414.42685

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N=C(N)NC2=CC=C(C=C2)C(F)(F)F)NCCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=NC(=N1)/N=C(\N)/NC2=CC=C(C=C2)C(F)(F)F)NCCC3=CC=CC=C3

InChI

InChI=1S/C21H21F3N6/c1-14-13-18(26-12-11-15-5-3-2-4-6-15)29-20(27-14)30-19(25)28-17-9-7-16(8-10-17)21(22,23)24/h2-10,13H,11-12H2,1H3,(H4,25,26,27,28,29,30)