2-azanyl-3-[1-(ethylcarbamoylamino)-1-oxidanylidene-propan-2-yl]sulfanyl-propanoic acid

Systemtic Name: 2-azanyl-3-[1-(ethylcarbamoylamino)-1-oxidanylidene-propan-2-yl]sulfanyl-propanoic acid Openeye Name: 2-amino-3-[2-(ethylcarbamoylamino)-1-methyl-2-oxo-ethyl]sulfanyl-propanoic acid CAS Name: 2-amino-3-[[1-(ethylcarbamoylamino)-1-oxopropan-2-yl]thio]propanoic acid IUPAC Name: 2-amino-3-[1-(ethylcarbamoylamino)-1-oxopropan-2-yl]sulfanylpropanoic acid Traditional Name: 2-amino-3-[[2-(ethylcarbamoylamino)-2-keto-1-methyl-ethyl]thio]propionic acid Formula: C9H17N3O4S MolecularWeight: 263.31398

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(C)SCC(C(=O)O)N

Isomeric SMILES

CCNC(=O)NC(=O)C(C)SCC(C(=O)O)N

InChI

InChI=1S/C9H17N3O4S/c1-3-11-9(16)12-7(13)5(2)17-4-6(10)8(14)15/h5-6H,3-4,10H2,1-2H3,(H,14,15)(H2,11,12,13,16)