2-[4-(4-methylphenyl)-8-(trifluoromethyl)phthalazin-1-yl]guanidine

Systemtic Name: 2-[4-(4-methylphenyl)-8-(trifluoromethyl)phthalazin-1-yl]guanidine Openeye Name: 2-[4-(p-tolyl)-8-(trifluoromethyl)phthalazin-1-yl]guanidine CAS Name: 2-[4-(4-methylphenyl)-8-(trifluoromethyl)-1-phthalazinyl]guanidine IUPAC Name: 2-[4-(4-methylphenyl)-8-(trifluoromethyl)phthalazin-1-yl]guanidine Traditional Name: 2-[4-(p-tolyl)-8-(trifluoromethyl)phthalazin-1-yl]guanidine Formula: C17H14F3N5 MolecularWeight: 345.32177

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(C3=C2C=CC=C3C(F)(F)F)N=C(N)N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(C3=C2C=CC=C3C(F)(F)F)N=C(N)N

InChI

InChI=1S/C17H14F3N5/c1-9-5-7-10(8-6-9)14-11-3-2-4-12(17(18,19)20)13(11)15(25-24-14)23-16(21)22/h2-8H,1H3,(H4,21,22,23,25)