3-[5-[2-(4-bromophenyl)sulfonylethylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 3-[5-[2-(4-bromophenyl)sulfonylethylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]pyridine Openeye Name: 3-[5-[2-(4-bromophenyl)sulfonylethylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]pyridine CAS Name: 3-[5-[2-(4-bromophenyl)sulfonylethylthio]-4-methyl-1,2,4-triazol-3-yl]pyridine IUPAC Name: 3-[5-[2-(4-bromophenyl)sulfonylethylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]pyridine Traditional Name: 3-[5-(2-brosylethylthio)-4-methyl-1,2,4-triazol-3-yl]pyridine Formula: C16H15BrN4O2S2 MolecularWeight: 439.3499

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCS(=O)(=O)C2=CC=C(C=C2)Br)C3=CN=CC=C3

Isomeric SMILES

CN1C(=NN=C1SCCS(=O)(=O)C2=CC=C(C=C2)Br)C3=CN=CC=C3

InChI

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