2-[3-(4-chlorophenyl)sulfonyl-1-(phenylmethyl)indol-2-yl]sulfanylethanamine hydrobromide

Systemtic Name: 2-[3-(4-chlorophenyl)sulfonyl-1-(phenylmethyl)indol-2-yl]sulfanylethanamine hydrobromide Openeye Name: 2-[1-benzyl-3-(4-chlorophenyl)sulfonyl-indol-2-yl]sulfanylethanamine hydrobromide CAS Name: 2-[[3-(4-chlorophenyl)sulfonyl-1-(phenylmethyl)-2-indolyl]thio]ethanamine hydrobromide IUPAC Name: 2-[1-benzyl-3-(4-chlorophenyl)sulfonylindol-2-yl]sulfanylethanamine hydrobromide Traditional Name: 2-[[1-benzyl-3-(4-chlorophenyl)sulfonyl-indol-2-yl]thio]ethylamine hydrobromide Formula: C23H22BrClN2O2S2 MolecularWeight: 537.91998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=CC=CC=C3C(=C2SCCN)S(=O)(=O)C4=CC=C(C=C4)Cl.Br

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=CC=CC=C3C(=C2SCCN)S(=O)(=O)C4=CC=C(C=C4)Cl.Br

InChI

InChI=1S/C23H21ClN2O2S2.BrH/c24-18-10-12-19(13-11-18)30(27,28)22-20-8-4-5-9-21(20)26(23(22)29-15-14-25)16-17-6-2-1-3-7-17;/h1-13H,14-16,25H2;1H