2-(2-butylsulfanylethanoylamino)propanoic acid

Systemtic Name: 2-(2-butylsulfanylethanoylamino)propanoic acid Openeye Name: 2-[(2-butylsulfanylacetyl)amino]propanoic acid CAS Name: 2-[[2-(butylthio)-1-oxoethyl]amino]propanoic acid IUPAC Name: 2-[(2-butylsulfanylacetyl)amino]propanoic acid Traditional Name: 2-[[2-(butylthio)acetyl]amino]propionic acid Formula: C9H17NO3S MolecularWeight: 219.30118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H17NO3S/c1-3-4-5-14-6-8(11)10-7(2)9(12)13/h7H,3-6H2,1-2H3,(H,10,11)(H,12,13)