(2S)-2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanyl-N-(4-sulfamoylphenyl)propanamide

Systemtic Name: (2S)-2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanyl-N-(4-sulfamoylphenyl)propanamide Openeye Name: (2S)-2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanyl-N-(4-sulfamoylphenyl)propanamide CAS Name: (2S)-2-[[1-(3,5-dimethylphenyl)-2-imidazolyl]thio]-N-(4-sulfamoylphenyl)propanamide IUPAC Name: (2S)-2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanyl-N-(4-sulfamoylphenyl)propanamide Traditional Name: (2S)-2-[[1-(3,5-dimethylphenyl)imidazol-2-yl]thio]-N-(4-sulfamoylphenyl)propionamide Formula: C20H22N4O3S2 MolecularWeight: 430.54368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C=CN=C2SC(C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C=CN=C2S[C@@H](C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N)C

InChI

InChI=1S/C20H22N4O3S2/c1-13-10-14(2)12-17(11-13)24-9-8-22-20(24)28-15(3)19(25)23-16-4-6-18(7-5-16)29(21,26)27/h4-12,15H,1-3H3,(H,23,25)(H2,21,26,27)/t15-/m0/s1