3-(1,3-benzodioxol-5-yl)-4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazole

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazole Openeye Name: 3-(1,3-benzodioxol-5-yl)-5-benzylsulfanyl-4-methyl-1,2,4-triazole CAS Name: 3-(1,3-benzodioxol-5-yl)-4-methyl-5-(phenylmethylthio)-1,2,4-triazole IUPAC Name: 3-(1,3-benzodioxol-5-yl)-5-benzylsulfanyl-4-methyl-1,2,4-triazole Traditional Name: 3-(1,3-benzodioxol-5-yl)-5-(benzylthio)-4-methyl-1,2,4-triazole Formula: C17H15N3O2S MolecularWeight: 325.3849

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC=CC=C2)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CN1C(=NN=C1SCC2=CC=CC=C2)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H15N3O2S/c1-20-16(13-7-8-14-15(9-13)22-11-21-14)18-19-17(20)23-10-12-5-3-2-4-6-12/h2-9H,10-11H2,1H3