N-[[5-chloranyl-3-methyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]methylideneamino]phthalazin-1-amine

Systemtic Name: N-[[5-chloranyl-3-methyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]methylideneamino]phthalazin-1-amine Openeye Name: N-[[5-chloro-3-methyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]methyleneamino]phthalazin-1-amine CAS Name: N-[[5-chloro-3-methyl-1-[3-(trifluoromethyl)phenyl]-4-pyrazolyl]methylideneamino]-1-phthalazinamine IUPAC Name: N-[[5-chloro-3-methyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]methylideneamino]phthalazin-1-amine Traditional Name: [[5-chloro-3-methyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]methyleneamino]-phthalazin-1-yl-amine Formula: C20H14ClF3N6 MolecularWeight: 430.81357

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NNC2=NN=CC3=CC=CC=C32)Cl)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

CC1=NN(C(=C1C=NNC2=NN=CC3=CC=CC=C32)Cl)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C20H14ClF3N6/c1-12-17(11-26-28-19-16-8-3-2-5-13(16)10-25-27-19)18(21)30(29-12)15-7-4-6-14(9-15)20(22,23)24/h2-11H,1H3,(H,27,28)