N-[4-chloranyl-3-(trifluoromethyl)phenyl]-4-(pyridin-4-ylmethyl)phthalazin-1-amine

Systemtic Name: N-[4-chloranyl-3-(trifluoromethyl)phenyl]-4-(pyridin-4-ylmethyl)phthalazin-1-amine Openeye Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-4-(4-pyridylmethyl)phthalazin-1-amine CAS Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-4-(pyridin-4-ylmethyl)-1-phthalazinamine IUPAC Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-4-(pyridin-4-ylmethyl)phthalazin-1-amine Traditional Name: [4-chloro-3-(trifluoromethyl)phenyl]-[4-(4-pyridylmethyl)phthalazin-1-yl]amine Formula: C21H14ClF3N4 MolecularWeight: 414.81087

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H14ClF3N4/c22-18-6-5-14(12-17(18)21(23,24)25)27-20-16-4-2-1-3-15(16)19(28-29-20)11-13-7-9-26-10-8-13/h1-10,12H,11H2,(H,27,29)