2-(2-butylsulfanylethanoylamino)-3-oxidanyl-propanoic acid

Systemtic Name: 2-(2-butylsulfanylethanoylamino)-3-oxidanyl-propanoic acid Openeye Name: 2-[(2-butylsulfanylacetyl)amino]-3-hydroxy-propanoic acid CAS Name: 2-[[2-(butylthio)-1-oxoethyl]amino]-3-hydroxypropanoic acid IUPAC Name: 2-[(2-butylsulfanylacetyl)amino]-3-hydroxypropanoic acid Traditional Name: 2-[[2-(butylthio)acetyl]amino]-3-hydroxy-propionic acid Formula: C9H17NO4S MolecularWeight: 235.30058

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCC(=O)NC(CO)C(=O)O

Isomeric SMILES

CCCCSCC(=O)NC(CO)C(=O)O

InChI

InChI=1S/C9H17NO4S/c1-2-3-4-15-6-8(12)10-7(5-11)9(13)14/h7,11H,2-6H2,1H3,(H,10,12)(H,13,14)