5-(4-chloranylnaphthalen-1-yl)-1H-1,2,4-triazol-3-amine

Systemtic Name: 5-(4-chloranylnaphthalen-1-yl)-1H-1,2,4-triazol-3-amine Openeye Name: 5-(4-chloro-1-naphthyl)-1H-1,2,4-triazol-3-amine CAS Name: 5-(4-chloro-1-naphthalenyl)-1H-1,2,4-triazol-3-amine IUPAC Name: 5-(4-chloronaphthalen-1-yl)-1H-1,2,4-triazol-3-amine Traditional Name: [5-(4-chloro-1-naphthyl)-1H-1,2,4-triazol-3-yl]amine Formula: C12H9ClN4 MolecularWeight: 244.67966

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=C2Cl)C3=NC(=NN3)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=C2Cl)C3=NC(=NN3)N

InChI

InChI=1S/C12H9ClN4/c13-10-6-5-9(11-15-12(14)17-16-11)7-3-1-2-4-8(7)10/h1-6H,(H3,14,15,16,17)