3-(1,3-benzodioxol-5-ylmethylsulfanyl)-5-cyclopropyl-4-methyl-1,2,4-triazole

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethylsulfanyl)-5-cyclopropyl-4-methyl-1,2,4-triazole Openeye Name: 3-(1,3-benzodioxol-5-ylmethylsulfanyl)-5-cyclopropyl-4-methyl-1,2,4-triazole CAS Name: 3-(1,3-benzodioxol-5-ylmethylthio)-5-cyclopropyl-4-methyl-1,2,4-triazole IUPAC Name: 3-(1,3-benzodioxol-5-ylmethylsulfanyl)-5-cyclopropyl-4-methyl-1,2,4-triazole Traditional Name: 3-cyclopropyl-4-methyl-5-(piperonylthio)-1,2,4-triazole Formula: C14H15N3O2S MolecularWeight: 289.3528

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC3=C(C=C2)OCO3)C4CC4

Isomeric SMILES

CN1C(=NN=C1SCC2=CC3=C(C=C2)OCO3)C4CC4

InChI

InChI=1S/C14H15N3O2S/c1-17-13(10-3-4-10)15-16-14(17)20-7-9-2-5-11-12(6-9)19-8-18-11/h2,5-6,10H,3-4,7-8H2,1H3