methyl 3-[(E)-C-(2,2-dimethylpropyl)-N-(methoxycarbonylamino)carbonimidoyl]sulfanylpropanoate

Systemtic Name: methyl 3-[(E)-C-(2,2-dimethylpropyl)-N-(methoxycarbonylamino)carbonimidoyl]sulfanylpropanoate Openeye Name: methyl 3-[(E)-C-(2,2-dimethylpropyl)-N-(methoxycarbonylamino)carbonimidoyl]sulfanylpropanoate CAS Name: 3-[[(1E)-1-(methoxycarbonylhydrazinylidene)-3,3-dimethylbutyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[(E)-C-(2,2-dimethylpropyl)-N-(methoxycarbonylamino)carbonimidoyl]sulfanylpropanoate Traditional Name: 3-[[(E)-N-(carbomethoxyamino)-C-neopentyl-carbonimidoyl]thio]propionic acid methyl ester Formula: C12H22N2O4S MolecularWeight: 290.37908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=NNC(=O)OC)SCCC(=O)OC

Isomeric SMILES

CC(C)(C)C/C(=N\NC(=O)OC)/SCCC(=O)OC

InChI

InChI=1S/C12H22N2O4S/c1-12(2,3)8-9(13-14-11(16)18-5)19-7-6-10(15)17-4/h6-8H2,1-5H3,(H,14,16)/b13-9+