1-[2-(aminocarbonylamino)-4-methylsulfanyl-butanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-(aminocarbonylamino)-4-methylsulfanyl-butanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-(4-methylsulfanyl-2-ureido-butanoyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[2-(carbamoylamino)-4-(methylthio)-1-oxobutyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-(carbamoylamino)-4-methylsulfanylbutanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[4-(methylthio)-2-ureido-butanoyl]proline Formula: C11H19N3O4S MolecularWeight: 289.35126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)N1CCCC1C(=O)O)NC(=O)N

Isomeric SMILES

CSCCC(C(=O)N1CCCC1C(=O)O)NC(=O)N

InChI

InChI=1S/C11H19N3O4S/c1-19-6-4-7(13-11(12)18)9(15)14-5-2-3-8(14)10(16)17/h7-8H,2-6H2,1H3,(H,16,17)(H3,12,13,18)