2-[5-chloranyl-1-(4-propan-2-ylphenyl)sulfonyl-indol-3-yl]sulfanyl-N,N-dimethyl-ethanamine

Systemtic Name: 2-[5-chloranyl-1-(4-propan-2-ylphenyl)sulfonyl-indol-3-yl]sulfanyl-N,N-dimethyl-ethanamine Openeye Name: 2-[5-chloro-1-(4-isopropylphenyl)sulfonyl-indol-3-yl]sulfanyl-N,N-dimethyl-ethanamine CAS Name: 2-[[5-chloro-1-(4-propan-2-ylphenyl)sulfonyl-3-indolyl]thio]-N,N-dimethylethanamine IUPAC Name: 2-[5-chloro-1-(4-propan-2-ylphenyl)sulfonylindol-3-yl]sulfanyl-N,N-dimethylethanamine Traditional Name: 2-[(5-chloro-1-p-cumenylsulfonyl-indol-3-yl)thio]ethyl-dimethyl-amine Formula: C21H25ClN2O2S2 MolecularWeight: 437.0184

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=CC(=C3)Cl)SCCN(C)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=CC(=C3)Cl)SCCN(C)C

InChI

InChI=1S/C21H25ClN2O2S2/c1-15(2)16-5-8-18(9-6-16)28(25,26)24-14-21(27-12-11-23(3)4)19-13-17(22)7-10-20(19)24/h5-10,13-15H,11-12H2,1-4H3