2-[2-(4-bromophenyl)sulfonylethylsulfanyl]pyridin-3-amine

Systemtic Name: 2-[2-(4-bromophenyl)sulfonylethylsulfanyl]pyridin-3-amine Openeye Name: 2-[2-(4-bromophenyl)sulfonylethylsulfanyl]pyridin-3-amine CAS Name: 2-[2-(4-bromophenyl)sulfonylethylthio]-3-pyridinamine IUPAC Name: 2-[2-(4-bromophenyl)sulfonylethylsulfanyl]pyridin-3-amine Traditional Name: [2-(2-brosylethylthio)-3-pyridyl]amine Formula: C13H13BrN2O2S2 MolecularWeight: 373.28852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SCCS(=O)(=O)C2=CC=C(C=C2)Br)N

Isomeric SMILES

C1=CC(=C(N=C1)SCCS(=O)(=O)C2=CC=C(C=C2)Br)N

InChI

InChI=1S/C13H13BrN2O2S2/c14-10-3-5-11(6-4-10)20(17,18)9-8-19-13-12(15)2-1-7-16-13/h1-7H,8-9,15H2