2-[2-[(1-cyanocyclohexyl)amino]-2-oxidanylidene-ethyl]sulfanylpropanoic acid

Systemtic Name: 2-[2-[(1-cyanocyclohexyl)amino]-2-oxidanylidene-ethyl]sulfanylpropanoic acid Openeye Name: 2-[2-[(1-cyanocyclohexyl)amino]-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: 2-[[2-[(1-cyanocyclohexyl)amino]-2-oxoethyl]thio]propanoic acid IUPAC Name: 2-[2-[(1-cyanocyclohexyl)amino]-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 2-[[2-[(1-cyanocyclohexyl)amino]-2-keto-ethyl]thio]propionic acid Formula: C12H18N2O3S MolecularWeight: 270.34792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SCC(=O)NC1(CCCCC1)C#N

Isomeric SMILES

CC(C(=O)O)SCC(=O)NC1(CCCCC1)C#N

InChI

InChI=1S/C12H18N2O3S/c1-9(11(16)17)18-7-10(15)14-12(8-13)5-3-2-4-6-12/h9H,2-7H2,1H3,(H,14,15)(H,16,17)