N-(4-chlorophenyl)-4-[4-(1,2,4-triazol-1-yl)phenyl]phthalazin-1-amine

Systemtic Name: N-(4-chlorophenyl)-4-[4-(1,2,4-triazol-1-yl)phenyl]phthalazin-1-amine Openeye Name: N-(4-chlorophenyl)-4-[4-(1,2,4-triazol-1-yl)phenyl]phthalazin-1-amine CAS Name: N-(4-chlorophenyl)-4-[4-(1,2,4-triazol-1-yl)phenyl]-1-phthalazinamine IUPAC Name: N-(4-chlorophenyl)-4-[4-(1,2,4-triazol-1-yl)phenyl]phthalazin-1-amine Traditional Name: (4-chlorophenyl)-[4-[4-(1,2,4-triazol-1-yl)phenyl]phthalazin-1-yl]amine Formula: C22H15ClN6 MolecularWeight: 398.8477

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H15ClN6/c23-16-7-9-17(10-8-16)26-22-20-4-2-1-3-19(20)21(27-28-22)15-5-11-18(12-6-15)29-14-24-13-25-29/h1-14H,(H,26,28)