2-azanyl-3-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-propanoic acid

Systemtic Name: 2-azanyl-3-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-propanoic acid Openeye Name: 2-amino-3-[2-(4-methyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-propanoic acid CAS Name: 2-amino-3-[[2-(4-methyl-1-piperidinyl)-2-oxoethyl]thio]propanoic acid IUPAC Name: 2-amino-3-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 2-amino-3-[[2-keto-2-(4-methylpiperidino)ethyl]thio]propionic acid Formula: C11H20N2O3S MolecularWeight: 260.3531

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)CSCC(C(=O)O)N

Isomeric SMILES

CC1CCN(CC1)C(=O)CSCC(C(=O)O)N

InChI

InChI=1S/C11H20N2O3S/c1-8-2-4-13(5-3-8)10(14)7-17-6-9(12)11(15)16/h8-9H,2-7,12H2,1H3,(H,15,16)