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

Systemtic Name: 4-phenyl-N-[2-(1,2,4-triazol-1-yl)ethyl]phthalazin-1-amine Openeye Name: 4-phenyl-N-[2-(1,2,4-triazol-1-yl)ethyl]phthalazin-1-amine CAS Name: 4-phenyl-N-[2-(1,2,4-triazol-1-yl)ethyl]-1-phthalazinamine IUPAC Name: 4-phenyl-N-[2-(1,2,4-triazol-1-yl)ethyl]phthalazin-1-amine Traditional Name: (4-phenylphthalazin-1-yl)-[2-(1,2,4-triazol-1-yl)ethyl]amine Formula: C18H16N6 MolecularWeight: 316.35984

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)NCCN4C=NC=N4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)NCCN4C=NC=N4

InChI

InChI=1S/C18H16N6/c1-2-6-14(7-3-1)17-15-8-4-5-9-16(15)18(23-22-17)20-10-11-24-13-19-12-21-24/h1-9,12-13H,10-11H2,(H,20,23)