4-(1,3-benzodioxol-5-yl)-3-(5-thiophen-2-yl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-3-(5-thiophen-2-yl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-(1,3-benzodioxol-5-yl)-3-[5-(2-thienyl)-1H-pyrazol-3-yl]-1H-1,2,4-triazole-5-thione CAS Name: 4-(1,3-benzodioxol-5-yl)-3-(5-thiophen-2-yl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(1,3-benzodioxol-5-yl)-3-(5-thiophen-2-yl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-(1,3-benzodioxol-5-yl)-3-[5-(2-thienyl)-1H-pyrazol-3-yl]-1H-1,2,4-triazole-5-thione Formula: C16H11N5O2S2 MolecularWeight: 369.42084

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)N3C(=NNC3=S)C4=NNC(=C4)C5=CC=CS5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)N3C(=NNC3=S)C4=NNC(=C4)C5=CC=CS5

InChI

InChI=1S/C16H11N5O2S2/c24-16-20-19-15(11-7-10(17-18-11)14-2-1-5-25-14)21(16)9-3-4-12-13(6-9)23-8-22-12/h1-7H,8H2,(H,17,18)(H,20,24)