(2S)-2-(aminocarbonylamino)-N-[4-methyl-3-(methylsulfamoyl)phenyl]-4-methylsulfanyl-butanamide

Systemtic Name: (2S)-2-(aminocarbonylamino)-N-[4-methyl-3-(methylsulfamoyl)phenyl]-4-methylsulfanyl-butanamide Openeye Name: (2S)-N-[4-methyl-3-(methylsulfamoyl)phenyl]-4-methylsulfanyl-2-ureido-butanamide CAS Name: (2S)-2-(carbamoylamino)-N-[4-methyl-3-(methylsulfamoyl)phenyl]-4-(methylthio)butanamide IUPAC Name: (2S)-2-(carbamoylamino)-N-[4-methyl-3-(methylsulfamoyl)phenyl]-4-methylsulfanylbutanamide Traditional Name: (2S)-N-[4-methyl-3-(methylsulfamoyl)phenyl]-4-(methylthio)-2-ureido-butyramide Formula: C14H22N4O4S2 MolecularWeight: 374.47888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22N4O4S2/c1-9-4-5-10(8-12(9)24(21,22)16-2)17-13(19)11(6-7-23-3)18-14(15)20/h4-5,8,11,16H,6-7H2,1-3H3,(H,17,19)(H3,15,18,20)/t11-/m0/s1