N-[4-chloranyl-3-(trifluoromethyl)phenyl]-4-[4-(1,2,3,4-tetrazol-1-yl)phenyl]phthalazin-1-amine

Systemtic Name: N-[4-chloranyl-3-(trifluoromethyl)phenyl]-4-[4-(1,2,3,4-tetrazol-1-yl)phenyl]phthalazin-1-amine Openeye Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-4-[4-(tetrazol-1-yl)phenyl]phthalazin-1-amine CAS Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-4-[4-(1-tetrazolyl)phenyl]-1-phthalazinamine IUPAC Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-4-[4-(tetrazol-1-yl)phenyl]phthalazin-1-amine Traditional Name: [4-chloro-3-(trifluoromethyl)phenyl]-[4-[4-(tetrazol-1-yl)phenyl]phthalazin-1-yl]amine Formula: C22H13ClF3N7 MolecularWeight: 467.83373

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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)C4=CC=C(C=C4)N5C=NN=N5

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN=C2NC3=CC(=C(C=C3)Cl)C(F)(F)F)C4=CC=C(C=C4)N5C=NN=N5

InChI

InChI=1S/C22H13ClF3N7/c23-19-10-7-14(11-18(19)22(24,25)26)28-21-17-4-2-1-3-16(17)20(29-30-21)13-5-8-15(9-6-13)33-12-27-31-32-33/h1-12H,(H,28,30)