4-(pyridin-4-ylmethyl)-N-[4-(trifluoromethyl)phenyl]phthalazin-1-amine

Systemtic Name: 4-(pyridin-4-ylmethyl)-N-[4-(trifluoromethyl)phenyl]phthalazin-1-amine Openeye Name: 4-(4-pyridylmethyl)-N-[4-(trifluoromethyl)phenyl]phthalazin-1-amine CAS Name: 4-(pyridin-4-ylmethyl)-N-[4-(trifluoromethyl)phenyl]-1-phthalazinamine IUPAC Name: 4-(pyridin-4-ylmethyl)-N-[4-(trifluoromethyl)phenyl]phthalazin-1-amine Traditional Name: [4-(4-pyridylmethyl)phthalazin-1-yl]-[4-(trifluoromethyl)phenyl]amine Formula: C21H15F3N4 MolecularWeight: 380.36581

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN=C2NC3=CC=C(C=C3)C(F)(F)F)CC4=CC=NC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN=C2NC3=CC=C(C=C3)C(F)(F)F)CC4=CC=NC=C4

InChI

InChI=1S/C21H15F3N4/c22-21(23,24)15-5-7-16(8-6-15)26-20-18-4-2-1-3-17(18)19(27-28-20)13-14-9-11-25-12-10-14/h1-12H,13H2,(H,26,28)