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

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethylsulfanyl)-4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazole Openeye Name: 3-(1,3-benzodioxol-5-ylmethylsulfanyl)-4-cyclopropyl-5-(2-thienyl)-1,2,4-triazole CAS Name: 3-(1,3-benzodioxol-5-ylmethylthio)-4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazole IUPAC Name: 3-(1,3-benzodioxol-5-ylmethylsulfanyl)-4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazole Traditional Name: 4-cyclopropyl-3-(piperonylthio)-5-(2-thienyl)-1,2,4-triazole Formula: C17H15N3O2S2 MolecularWeight: 357.4499

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCC3=CC4=C(C=C3)OCO4)C5=CC=CS5

Isomeric SMILES

C1CC1N2C(=NN=C2SCC3=CC4=C(C=C3)OCO4)C5=CC=CS5

InChI

InChI=1S/C17H15N3O2S2/c1-2-15(23-7-1)16-18-19-17(20(16)12-4-5-12)24-9-11-3-6-13-14(8-11)22-10-21-13/h1-3,6-8,12H,4-5,9-10H2