3-[4-[3-(2-azanyl-2-oxidanylidene-ethyl)sulfanylpropanoyl]piperazin-1-yl]propanoic acid

Systemtic Name: 3-[4-[3-(2-azanyl-2-oxidanylidene-ethyl)sulfanylpropanoyl]piperazin-1-yl]propanoic acid Openeye Name: 3-[4-[3-(2-amino-2-oxo-ethyl)sulfanylpropanoyl]piperazin-1-yl]propanoic acid CAS Name: 3-[4-[3-[(2-amino-2-oxoethyl)thio]-1-oxopropyl]-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-[3-(2-amino-2-oxoethyl)sulfanylpropanoyl]piperazin-1-yl]propanoic acid Traditional Name: 3-[4-[3-[(2-amino-2-keto-ethyl)thio]propanoyl]piperazino]propionic acid Formula: C12H21N3O4S MolecularWeight: 303.37784

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)O)C(=O)CCSCC(=O)N

Isomeric SMILES

C1CN(CCN1CCC(=O)O)C(=O)CCSCC(=O)N

InChI

InChI=1S/C12H21N3O4S/c13-10(16)9-20-8-2-11(17)15-6-4-14(5-7-15)3-1-12(18)19/h1-9H2,(H2,13,16)(H,18,19)