5-[(6-bromanyl-1,3-benzodioxol-5-yl)methylsulfanyl]-1-phenyl-1,2,3,4-tetrazole

Systemtic Name: 5-[(6-bromanyl-1,3-benzodioxol-5-yl)methylsulfanyl]-1-phenyl-1,2,3,4-tetrazole Openeye Name: 5-[(6-bromo-1,3-benzodioxol-5-yl)methylsulfanyl]-1-phenyl-tetrazole CAS Name: 5-[(6-bromo-1,3-benzodioxol-5-yl)methylthio]-1-phenyltetrazole IUPAC Name: 5-[(6-bromo-1,3-benzodioxol-5-yl)methylsulfanyl]-1-phenyltetrazole Traditional Name: 5-[(6-bromo-1,3-benzodioxol-5-yl)methylthio]-1-phenyl-tetrazole Formula: C15H11BrN4O2S MolecularWeight: 391.24244

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H11BrN4O2S/c16-12-7-14-13(21-9-22-14)6-10(12)8-23-15-17-18-19-20(15)11-4-2-1-3-5-11/h1-7H,8-9H2