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

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethylsulfanyl)-5-thiophen-2-yl-1H-1,2,4-triazole Openeye Name: 3-(1,3-benzodioxol-5-ylmethylsulfanyl)-5-(2-thienyl)-1H-1,2,4-triazole CAS Name: 3-(1,3-benzodioxol-5-ylmethylthio)-5-thiophen-2-yl-1H-1,2,4-triazole IUPAC Name: 3-(1,3-benzodioxol-5-ylmethylsulfanyl)-5-thiophen-2-yl-1H-1,2,4-triazole Traditional Name: 3-(piperonylthio)-5-(2-thienyl)-1H-1,2,4-triazole Formula: C14H11N3O2S2 MolecularWeight: 317.38604

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CSC3=NNC(=N3)C4=CC=CS4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CSC3=NNC(=N3)C4=CC=CS4

InChI

InChI=1S/C14H11N3O2S2/c1-2-12(20-5-1)13-15-14(17-16-13)21-7-9-3-4-10-11(6-9)19-8-18-10/h1-6H,7-8H2,(H,15,16,17)