4-(2-propan-2-ylsulfanylethanoylamino)butanoic acid

Systemtic Name: 4-(2-propan-2-ylsulfanylethanoylamino)butanoic acid Openeye Name: 4-[(2-isopropylsulfanylacetyl)amino]butanoic acid CAS Name: 4-[[1-oxo-2-(propan-2-ylthio)ethyl]amino]butanoic acid IUPAC Name: 4-[(2-propan-2-ylsulfanylacetyl)amino]butanoic acid Traditional Name: 4-[[2-(isopropylthio)acetyl]amino]butyric acid Formula: C9H17NO3S MolecularWeight: 219.30118

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SCC(=O)NCCCC(=O)O

Isomeric SMILES

CC(C)SCC(=O)NCCCC(=O)O

InChI

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