2-[(2,5-dimethylphenyl)-methylsulfonyl-amino]-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]propanamide

Systemtic Name: 2-[(2,5-dimethylphenyl)-methylsulfonyl-amino]-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]propanamide Openeye Name: 2-(2,5-dimethyl-N-methylsulfonyl-anilino)-N-[4-(thiazol-2-ylsulfamoyl)phenyl]propanamide CAS Name: 2-(2,5-dimethyl-N-methylsulfonylanilino)-N-[4-(2-thiazolylsulfamoyl)phenyl]propanamide IUPAC Name: 2-(2,5-dimethyl-N-methylsulfonylanilino)-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]propanamide Traditional Name: 2-(N-mesyl-2,5-dimethyl-anilino)-N-[4-(thiazol-2-ylsulfamoyl)phenyl]propionamide Formula: C21H24N4O5S3 MolecularWeight: 508.63406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N(C(C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)N(C(C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3)S(=O)(=O)C

InChI

InChI=1S/C21H24N4O5S3/c1-14-5-6-15(2)19(13-14)25(32(4,27)28)16(3)20(26)23-17-7-9-18(10-8-17)33(29,30)24-21-22-11-12-31-21/h5-13,16H,1-4H3,(H,22,24)(H,23,26)