4-[1-(phenylmethyl)pyrazol-4-yl]-3-(1H-pyrazol-5-yl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[1-(phenylmethyl)pyrazol-4-yl]-3-(1H-pyrazol-5-yl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-(1-benzylpyrazol-4-yl)-3-(1H-pyrazol-5-yl)-1H-1,2,4-triazole-5-thione CAS Name: 4-[1-(phenylmethyl)-4-pyrazolyl]-3-(1H-pyrazol-5-yl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(1-benzylpyrazol-4-yl)-3-(1H-pyrazol-5-yl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-(1-benzylpyrazol-4-yl)-3-(1H-pyrazol-5-yl)-1H-1,2,4-triazole-5-thione Formula: C15H13N7S MolecularWeight: 323.37562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C=N2)N3C(=NNC3=S)C4=CC=NN4

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C=N2)N3C(=NNC3=S)C4=CC=NN4

InChI

InChI=1S/C15H13N7S/c23-15-20-19-14(13-6-7-16-18-13)22(15)12-8-17-21(10-12)9-11-4-2-1-3-5-11/h1-8,10H,9H2,(H,16,18)(H,20,23)