ethyl 3-[(E)-N-(methoxycarbonylamino)-C-(phenylmethyl)carbonimidoyl]sulfanylpropanoate

Systemtic Name: ethyl 3-[(E)-N-(methoxycarbonylamino)-C-(phenylmethyl)carbonimidoyl]sulfanylpropanoate Openeye Name: ethyl 3-[(E)-C-benzyl-N-(methoxycarbonylamino)carbonimidoyl]sulfanylpropanoate CAS Name: 3-[[(1E)-1-(methoxycarbonylhydrazinylidene)-2-phenylethyl]thio]propanoic acid ethyl ester IUPAC Name: ethyl 3-[(E)-C-benzyl-N-(methoxycarbonylamino)carbonimidoyl]sulfanylpropanoate Traditional Name: 3-[[(E)-C-benzyl-N-(carbomethoxyamino)carbonimidoyl]thio]propionic acid ethyl ester Formula: C15H20N2O4S MolecularWeight: 324.3953

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCSC(=NNC(=O)OC)CC1=CC=CC=C1

Isomeric SMILES

CCOC(=O)CCS/C(=N/NC(=O)OC)/CC1=CC=CC=C1

InChI

InChI=1S/C15H20N2O4S/c1-3-21-14(18)9-10-22-13(16-17-15(19)20-2)11-12-7-5-4-6-8-12/h4-8H,3,9-11H2,1-2H3,(H,17,19)/b16-13+