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

Systemtic Name: 5-[(6-bromanyl-1,3-benzodioxol-5-yl)methylsulfanyl]-1-(2-methoxy-5-methyl-phenyl)-1,2,3,4-tetrazole Openeye Name: 5-[(6-bromo-1,3-benzodioxol-5-yl)methylsulfanyl]-1-(2-methoxy-5-methyl-phenyl)tetrazole CAS Name: 5-[(6-bromo-1,3-benzodioxol-5-yl)methylthio]-1-(2-methoxy-5-methylphenyl)tetrazole IUPAC Name: 5-[(6-bromo-1,3-benzodioxol-5-yl)methylsulfanyl]-1-(2-methoxy-5-methylphenyl)tetrazole Traditional Name: 5-[(6-bromo-1,3-benzodioxol-5-yl)methylthio]-1-(2-methoxy-5-methyl-phenyl)tetrazole Formula: C17H15BrN4O3S MolecularWeight: 435.295

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)N2C(=NN=N2)SCC3=CC4=C(C=C3Br)OCO4

Isomeric SMILES

CC1=CC(=C(C=C1)OC)N2C(=NN=N2)SCC3=CC4=C(C=C3Br)OCO4

InChI

InChI=1S/C17H15BrN4O3S/c1-10-3-4-14(23-2)13(5-10)22-17(19-20-21-22)26-8-11-6-15-16(7-12(11)18)25-9-24-15/h3-7H,8-9H2,1-2H3