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

Systemtic Name: 4-[5-[2-(4-bromophenyl)sulfonylethylsulfanyl]-4-ethyl-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[5-[2-(4-bromophenyl)sulfonylethylsulfanyl]-4-ethyl-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[5-[2-(4-bromophenyl)sulfonylethylthio]-4-ethyl-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[5-[2-(4-bromophenyl)sulfonylethylsulfanyl]-4-ethyl-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[5-(2-brosylethylthio)-4-ethyl-1,2,4-triazol-3-yl]pyridine Formula: C17H17BrN4O2S2 MolecularWeight: 453.37648

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCCS(=O)(=O)C2=CC=C(C=C2)Br)C3=CC=NC=C3

Isomeric SMILES

CCN1C(=NN=C1SCCS(=O)(=O)C2=CC=C(C=C2)Br)C3=CC=NC=C3

InChI

InChI=1S/C17H17BrN4O2S2/c1-2-22-16(13-7-9-19-10-8-13)20-21-17(22)25-11-12-26(23,24)15-5-3-14(18)4-6-15/h3-10H,2,11-12H2,1H3