6-[[2-(aminocarbonylamino)-4-methylsulfanyl-butanoyl]amino]hexanoic acid

Systemtic Name: 6-[[2-(aminocarbonylamino)-4-methylsulfanyl-butanoyl]amino]hexanoic acid Openeye Name: 6-[(4-methylsulfanyl-2-ureido-butanoyl)amino]hexanoic acid CAS Name: 6-[[2-(carbamoylamino)-4-(methylthio)-1-oxobutyl]amino]hexanoic acid IUPAC Name: 6-[[2-(carbamoylamino)-4-methylsulfanylbutanoyl]amino]hexanoic acid Traditional Name: 6-[[4-(methylthio)-2-ureido-butanoyl]amino]hexanoic acid Formula: C12H23N3O4S MolecularWeight: 305.39372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCCCCCC(=O)O)NC(=O)N

Isomeric SMILES

CSCCC(C(=O)NCCCCCC(=O)O)NC(=O)N

InChI

InChI=1S/C12H23N3O4S/c1-20-8-6-9(15-12(13)19)11(18)14-7-4-2-3-5-10(16)17/h9H,2-8H2,1H3,(H,14,18)(H,16,17)(H3,13,15,19)