N-[2-(4-sulfamoylphenyl)ethyl]-2-(4,6,8-trimethylquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-(4-sulfamoylphenyl)ethyl]-2-(4,6,8-trimethylquinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-[2-(4-sulfamoylphenyl)ethyl]-2-[(4,6,8-trimethyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-[2-(4-sulfamoylphenyl)ethyl]-2-[(4,6,8-trimethyl-2-quinolinyl)thio]acetamide IUPAC Name: N-[2-(4-sulfamoylphenyl)ethyl]-2-(4,6,8-trimethylquinolin-2-yl)sulfanylacetamide Traditional Name: N-[2-(4-sulfamoylphenyl)ethyl]-2-[(4,6,8-trimethyl-2-quinolyl)thio]acetamide Formula: C22H25N3O3S2 MolecularWeight: 443.5822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)SCC(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)SCC(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N)C)C

InChI

InChI=1S/C22H25N3O3S2/c1-14-10-16(3)22-19(11-14)15(2)12-21(25-22)29-13-20(26)24-9-8-17-4-6-18(7-5-17)30(23,27)28/h4-7,10-12H,8-9,13H2,1-3H3,(H,24,26)(H2,23,27,28)