2-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]sulfanylpropanoic acid

Systemtic Name: 2-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]sulfanylpropanoic acid Openeye Name: 2-[2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: 2-[[2-(4-methyl-1-piperazinyl)-2-oxoethyl]thio]propanoic acid IUPAC Name: 2-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 2-[[2-keto-2-(4-methylpiperazino)ethyl]thio]propionic acid Formula: C10H18N2O3S MolecularWeight: 246.32652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SCC(=O)N1CCN(CC1)C

Isomeric SMILES

CC(C(=O)O)SCC(=O)N1CCN(CC1)C

InChI

InChI=1S/C10H18N2O3S/c1-8(10(14)15)16-7-9(13)12-5-3-11(2)4-6-12/h8H,3-7H2,1-2H3,(H,14,15)