5-[(3-bromophenyl)methylsulfanyl]-1-(2-methoxy-5-methyl-phenyl)-1,2,3,4-tetrazole

Systemtic Name: 5-[(3-bromophenyl)methylsulfanyl]-1-(2-methoxy-5-methyl-phenyl)-1,2,3,4-tetrazole Openeye Name: 5-[(3-bromophenyl)methylsulfanyl]-1-(2-methoxy-5-methyl-phenyl)tetrazole CAS Name: 5-[(3-bromophenyl)methylthio]-1-(2-methoxy-5-methylphenyl)tetrazole IUPAC Name: 5-[(3-bromophenyl)methylsulfanyl]-1-(2-methoxy-5-methylphenyl)tetrazole Traditional Name: 5-[(3-bromobenzyl)thio]-1-(2-methoxy-5-methyl-phenyl)tetrazole Formula: C16H15BrN4OS MolecularWeight: 391.2855

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15BrN4OS/c1-11-6-7-15(22-2)14(8-11)21-16(18-19-20-21)23-10-12-4-3-5-13(17)9-12/h3-9H,10H2,1-2H3