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

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethylsulfanyl)-4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole Openeye Name: 3-(1,3-benzodioxol-5-ylmethylsulfanyl)-4-cyclopropyl-5-(2-thienylmethyl)-1,2,4-triazole CAS Name: 3-(1,3-benzodioxol-5-ylmethylthio)-4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole IUPAC Name: 3-(1,3-benzodioxol-5-ylmethylsulfanyl)-4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole Traditional Name: 4-cyclopropyl-3-(piperonylthio)-5-(2-thenyl)-1,2,4-triazole Formula: C18H17N3O2S2 MolecularWeight: 371.47648

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCC3=CC4=C(C=C3)OCO4)CC5=CC=CS5

Isomeric SMILES

C1CC1N2C(=NN=C2SCC3=CC4=C(C=C3)OCO4)CC5=CC=CS5

InChI

InChI=1S/C18H17N3O2S2/c1-2-14(24-7-1)9-17-19-20-18(21(17)13-4-5-13)25-10-12-3-6-15-16(8-12)23-11-22-15/h1-3,6-8,13H,4-5,9-11H2