2-[[2-(aminocarbonylamino)-4-methylsulfanyl-butanoyl]amino]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[[2-(aminocarbonylamino)-4-methylsulfanyl-butanoyl]amino]-3-oxidanyl-propanoic acid Openeye Name: 3-hydroxy-2-[(4-methylsulfanyl-2-ureido-butanoyl)amino]propanoic acid CAS Name: 2-[[2-(carbamoylamino)-4-(methylthio)-1-oxobutyl]amino]-3-hydroxypropanoic acid IUPAC Name: 2-[[2-(carbamoylamino)-4-methylsulfanylbutanoyl]amino]-3-hydroxypropanoic acid Traditional Name: 3-hydroxy-2-[[4-(methylthio)-2-ureido-butanoyl]amino]propionic acid Formula: C9H17N3O5S MolecularWeight: 279.31338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H17N3O5S/c1-18-3-2-5(12-9(10)17)7(14)11-6(4-13)8(15)16/h5-6,13H,2-4H2,1H3,(H,11,14)(H,15,16)(H3,10,12,17)