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

Systemtic Name: 5-[(5-bromanyl-2-methoxy-phenyl)methylsulfanyl]-1-(2,6-dimethylphenyl)-1,2,3,4-tetrazole Openeye Name: 5-[(5-bromo-2-methoxy-phenyl)methylsulfanyl]-1-(2,6-dimethylphenyl)tetrazole CAS Name: 5-[(5-bromo-2-methoxyphenyl)methylthio]-1-(2,6-dimethylphenyl)tetrazole IUPAC Name: 5-[(5-bromo-2-methoxyphenyl)methylsulfanyl]-1-(2,6-dimethylphenyl)tetrazole Traditional Name: 5-[(5-bromo-2-methoxy-benzyl)thio]-1-(2,6-dimethylphenyl)tetrazole Formula: C17H17BrN4OS MolecularWeight: 405.31208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C(=NN=N2)SCC3=C(C=CC(=C3)Br)OC

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C(=NN=N2)SCC3=C(C=CC(=C3)Br)OC

InChI

InChI=1S/C17H17BrN4OS/c1-11-5-4-6-12(2)16(11)22-17(19-20-21-22)24-10-13-9-14(18)7-8-15(13)23-3/h4-9H,10H2,1-3H3