2-azanyl-3-[2-oxidanylidene-2-(propylcarbamoylamino)ethyl]sulfanyl-propanoic acid

Systemtic Name: 2-azanyl-3-[2-oxidanylidene-2-(propylcarbamoylamino)ethyl]sulfanyl-propanoic acid Openeye Name: 2-amino-3-[2-oxo-2-(propylcarbamoylamino)ethyl]sulfanyl-propanoic acid CAS Name: 2-amino-3-[[2-oxo-2-[[oxo(propylamino)methyl]amino]ethyl]thio]propanoic acid IUPAC Name: 2-amino-3-[2-oxo-2-(propylcarbamoylamino)ethyl]sulfanylpropanoic acid Traditional Name: 2-amino-3-[[2-keto-2-(propylcarbamoylamino)ethyl]thio]propionic acid Formula: C9H17N3O4S MolecularWeight: 263.31398

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC(=O)CSCC(C(=O)O)N

Isomeric SMILES

CCCNC(=O)NC(=O)CSCC(C(=O)O)N

InChI

InChI=1S/C9H17N3O4S/c1-2-3-11-9(16)12-7(13)5-17-4-6(10)8(14)15/h6H,2-5,10H2,1H3,(H,14,15)(H2,11,12,13,16)