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

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethylsulfanyl)-4,5-diphenyl-1,2,4-triazole Openeye Name: 3-(1,3-benzodioxol-5-ylmethylsulfanyl)-4,5-diphenyl-1,2,4-triazole CAS Name: 3-(1,3-benzodioxol-5-ylmethylthio)-4,5-diphenyl-1,2,4-triazole IUPAC Name: 3-(1,3-benzodioxol-5-ylmethylsulfanyl)-4,5-diphenyl-1,2,4-triazole Traditional Name: 3,4-diphenyl-5-(piperonylthio)-1,2,4-triazole Formula: C22H17N3O2S MolecularWeight: 387.45428

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CSC3=NN=C(N3C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CSC3=NN=C(N3C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C22H17N3O2S/c1-3-7-17(8-4-1)21-23-24-22(25(21)18-9-5-2-6-10-18)28-14-16-11-12-19-20(13-16)27-15-26-19/h1-13H,14-15H2