5-(1,3-benzodioxol-5-ylmethylsulfanyl)-1-(2,3-dimethylphenyl)-1,2,3,4-tetrazole

Systemtic Name: 5-(1,3-benzodioxol-5-ylmethylsulfanyl)-1-(2,3-dimethylphenyl)-1,2,3,4-tetrazole Openeye Name: 5-(1,3-benzodioxol-5-ylmethylsulfanyl)-1-(2,3-dimethylphenyl)tetrazole CAS Name: 5-(1,3-benzodioxol-5-ylmethylthio)-1-(2,3-dimethylphenyl)tetrazole IUPAC Name: 5-(1,3-benzodioxol-5-ylmethylsulfanyl)-1-(2,3-dimethylphenyl)tetrazole Traditional Name: 1-(2,3-dimethylphenyl)-5-(piperonylthio)tetrazole Formula: C17H16N4O2S MolecularWeight: 340.39954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C(=NN=N2)SCC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C(=NN=N2)SCC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C17H16N4O2S/c1-11-4-3-5-14(12(11)2)21-17(18-19-20-21)24-9-13-6-7-15-16(8-13)23-10-22-15/h3-8H,9-10H2,1-2H3