N-[(2S)-1-[(4-methyl-3-sulfamoyl-phenyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: N-[(2S)-1-[(4-methyl-3-sulfamoyl-phenyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: N-[(1S)-1-[(4-methyl-3-sulfamoyl-phenyl)carbamoyl]-3-methylsulfanyl-propyl]benzamide CAS Name: N-[(2S)-1-(4-methyl-3-sulfamoylanilino)-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: N-[(2S)-1-(4-methyl-3-sulfamoylanilino)-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: N-[(1S)-1-[(4-methyl-3-sulfamoyl-phenyl)carbamoyl]-3-(methylthio)propyl]benzamide Formula: C19H23N3O4S2 MolecularWeight: 421.53362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(CCSC)NC(=O)C2=CC=CC=C2)S(=O)(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)[C@H](CCSC)NC(=O)C2=CC=CC=C2)S(=O)(=O)N

InChI

InChI=1S/C19H23N3O4S2/c1-13-8-9-15(12-17(13)28(20,25)26)21-19(24)16(10-11-27-2)22-18(23)14-6-4-3-5-7-14/h3-9,12,16H,10-11H2,1-2H3,(H,21,24)(H,22,23)(H2,20,25,26)/t16-/m0/s1