2-[5-bromanyl-1-(4-methoxyphenyl)sulfonyl-indol-3-yl]sulfinyl-N,N-dimethyl-ethanamine

Systemtic Name: 2-[5-bromanyl-1-(4-methoxyphenyl)sulfonyl-indol-3-yl]sulfinyl-N,N-dimethyl-ethanamine Openeye Name: 2-[5-bromo-1-(4-methoxyphenyl)sulfonyl-indol-3-yl]sulfinyl-N,N-dimethyl-ethanamine CAS Name: 2-[[5-bromo-1-(4-methoxyphenyl)sulfonyl-3-indolyl]sulfinyl]-N,N-dimethylethanamine IUPAC Name: 2-[5-bromo-1-(4-methoxyphenyl)sulfonylindol-3-yl]sulfinyl-N,N-dimethylethanamine Traditional Name: 2-[5-bromo-1-(4-methoxyphenyl)sulfonyl-indol-3-yl]sulfinylethyl-dimethyl-amine Formula: C19H21BrN2O4S2 MolecularWeight: 485.41504

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCS(=O)C1=CN(C2=C1C=C(C=C2)Br)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CN(C)CCS(=O)C1=CN(C2=C1C=C(C=C2)Br)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C19H21BrN2O4S2/c1-21(2)10-11-27(23)19-13-22(18-9-4-14(20)12-17(18)19)28(24,25)16-7-5-15(26-3)6-8-16/h4-9,12-13H,10-11H2,1-3H3