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

Systemtic Name: 3-[1-(2,5-dimethylphenyl)imidazol-2-yl]sulfanyl-N-(3-sulfamoylphenyl)propanamide Openeye Name: 3-[1-(2,5-dimethylphenyl)imidazol-2-yl]sulfanyl-N-(3-sulfamoylphenyl)propanamide CAS Name: 3-[[1-(2,5-dimethylphenyl)-2-imidazolyl]thio]-N-(3-sulfamoylphenyl)propanamide IUPAC Name: 3-[1-(2,5-dimethylphenyl)imidazol-2-yl]sulfanyl-N-(3-sulfamoylphenyl)propanamide Traditional Name: 3-[[1-(2,5-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(=C(C=C1)C)N2C=CN=C2SCCC(=O)NC3=CC(=CC=C3)S(=O)(=O)N

Isomeric SMILES

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

InChI

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