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

Systemtic Name: 5-(1,3-benzodioxol-5-ylmethylsulfanyl)-1-(3-chlorophenyl)-1,2,3,4-tetrazole Openeye Name: 5-(1,3-benzodioxol-5-ylmethylsulfanyl)-1-(3-chlorophenyl)tetrazole CAS Name: 5-(1,3-benzodioxol-5-ylmethylthio)-1-(3-chlorophenyl)tetrazole IUPAC Name: 5-(1,3-benzodioxol-5-ylmethylsulfanyl)-1-(3-chlorophenyl)tetrazole Traditional Name: 1-(3-chlorophenyl)-5-(piperonylthio)tetrazole Formula: C15H11ClN4O2S MolecularWeight: 346.79144

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CSC3=NN=NN3C4=CC(=CC=C4)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CSC3=NN=NN3C4=CC(=CC=C4)Cl

InChI

InChI=1S/C15H11ClN4O2S/c16-11-2-1-3-12(7-11)20-15(17-18-19-20)23-8-10-4-5-13-14(6-10)22-9-21-13/h1-7H,8-9H2