3-[2-(cyclohexylamino)-2-oxidanylidene-ethyl]sulfanylpropanoate

Systemtic Name: 3-[2-(cyclohexylamino)-2-oxidanylidene-ethyl]sulfanylpropanoate Openeye Name: 3-[2-(cyclohexylamino)-2-oxo-ethyl]sulfanylpropanoate CAS Name: 3-[[2-(cyclohexylamino)-2-oxoethyl]thio]propanoate IUPAC Name: 3-[2-(cyclohexylamino)-2-oxoethyl]sulfanylpropanoate Traditional Name: 3-[[2-(cyclohexylamino)-2-keto-ethyl]thio]propionate Formula: C11H18NO3S- MolecularWeight: 244.33052

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CSCCC(=O)[O-]

Isomeric SMILES

C1CCC(CC1)NC(=O)CSCCC(=O)[O-]

InChI

InChI=1S/C11H19NO3S/c13-10(8-16-7-6-11(14)15)12-9-4-2-1-3-5-9/h9H,1-8H2,(H,12,13)(H,14,15)/p-1