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

Systemtic Name: 3-(1-ethylpyrazol-4-yl)-4-[1-(phenylmethyl)pyrazol-4-yl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-(1-benzylpyrazol-4-yl)-3-(1-ethylpyrazol-4-yl)-1H-1,2,4-triazole-5-thione CAS Name: 3-(1-ethyl-4-pyrazolyl)-4-[1-(phenylmethyl)-4-pyrazolyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(1-benzylpyrazol-4-yl)-3-(1-ethylpyrazol-4-yl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-(1-benzylpyrazol-4-yl)-3-(1-ethylpyrazol-4-yl)-1H-1,2,4-triazole-5-thione Formula: C17H17N7S MolecularWeight: 351.42878

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)C2=NNC(=S)N2C3=CN(N=C3)CC4=CC=CC=C4

Isomeric SMILES

CCN1C=C(C=N1)C2=NNC(=S)N2C3=CN(N=C3)CC4=CC=CC=C4

InChI

InChI=1S/C17H17N7S/c1-2-22-11-14(8-18-22)16-20-21-17(25)24(16)15-9-19-23(12-15)10-13-6-4-3-5-7-13/h3-9,11-12H,2,10H2,1H3,(H,21,25)