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

Systemtic Name: 4-[5-[2-(4-bromophenyl)sulfonylethylsulfanyl]-4-cyclopropyl-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[5-[2-(4-bromophenyl)sulfonylethylsulfanyl]-4-cyclopropyl-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[5-[2-(4-bromophenyl)sulfonylethylthio]-4-cyclopropyl-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[5-[2-(4-bromophenyl)sulfonylethylsulfanyl]-4-cyclopropyl-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[5-(2-brosylethylthio)-4-cyclopropyl-1,2,4-triazol-3-yl]pyridine Formula: C18H17BrN4O2S2 MolecularWeight: 465.38718

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCCS(=O)(=O)C3=CC=C(C=C3)Br)C4=CC=NC=C4

Isomeric SMILES

C1CC1N2C(=NN=C2SCCS(=O)(=O)C3=CC=C(C=C3)Br)C4=CC=NC=C4

InChI

InChI=1S/C18H17BrN4O2S2/c19-14-1-5-16(6-2-14)27(24,25)12-11-26-18-22-21-17(23(18)15-3-4-15)13-7-9-20-10-8-13/h1-2,5-10,15H,3-4,11-12H2