3-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanyl-N-(3-sulfamoylphenyl)propanamide

Systemtic Name: 3-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanyl-N-(3-sulfamoylphenyl)propanamide Openeye Name: 3-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanyl-N-(3-sulfamoylphenyl)propanamide CAS Name: 3-[[1-(3,5-dimethylphenyl)-2-imidazolyl]thio]-N-(3-sulfamoylphenyl)propanamide IUPAC Name: 3-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanyl-N-(3-sulfamoylphenyl)propanamide Traditional Name: 3-[[1-(3,5-dimethylphenyl)imidazol-2-yl]thio]-N-(3-sulfamoylphenyl)propionamide Formula: C20H22N4O3S2 MolecularWeight: 430.54368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C=CN=C2SCCC(=O)NC3=CC(=CC=C3)S(=O)(=O)N)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C=CN=C2SCCC(=O)NC3=CC(=CC=C3)S(=O)(=O)N)C

InChI

InChI=1S/C20H22N4O3S2/c1-14-10-15(2)12-17(11-14)24-8-7-22-20(24)28-9-6-19(25)23-16-4-3-5-18(13-16)29(21,26)27/h3-5,7-8,10-13H,6,9H2,1-2H3,(H,23,25)(H2,21,26,27)