5-[2-(4-bromophenyl)sulfonylethylsulfanyl]-1-(3-methylphenyl)-1,2,3,4-tetrazole

Systemtic Name: 5-[2-(4-bromophenyl)sulfonylethylsulfanyl]-1-(3-methylphenyl)-1,2,3,4-tetrazole Openeye Name: 5-[2-(4-bromophenyl)sulfonylethylsulfanyl]-1-(m-tolyl)tetrazole CAS Name: 5-[2-(4-bromophenyl)sulfonylethylthio]-1-(3-methylphenyl)tetrazole IUPAC Name: 5-[2-(4-bromophenyl)sulfonylethylsulfanyl]-1-(3-methylphenyl)tetrazole Traditional Name: 5-(2-brosylethylthio)-1-(m-tolyl)tetrazole Formula: C16H15BrN4O2S2 MolecularWeight: 439.3499

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NN=N2)SCCS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NN=N2)SCCS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C16H15BrN4O2S2/c1-12-3-2-4-14(11-12)21-16(18-19-20-21)24-9-10-25(22,23)15-7-5-13(17)6-8-15/h2-8,11H,9-10H2,1H3