methyl (3Z)-3-aminocarbonylimino-3-methylsulfanyl-2-phenyl-propanoate

Systemtic Name: methyl (3Z)-3-aminocarbonylimino-3-methylsulfanyl-2-phenyl-propanoate Openeye Name: methyl (3Z)-3-carbamoylimino-3-methylsulfanyl-2-phenyl-propanoate CAS Name: (3Z)-3-carbamoylimino-3-(methylthio)-2-phenylpropanoic acid methyl ester IUPAC Name: methyl (3Z)-3-carbamoylimino-3-methylsulfanyl-2-phenylpropanoate Traditional Name: (3Z)-3-carbamoylimino-3-(methylthio)-2-phenyl-propionic acid methyl ester Formula: C12H14N2O3S MolecularWeight: 266.31616

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1)C(=NC(=O)N)SC

Isomeric SMILES

COC(=O)C(C1=CC=CC=C1)/C(=N/C(=O)N)/SC

InChI

InChI=1S/C12H14N2O3S/c1-17-11(15)9(8-6-4-3-5-7-8)10(18-2)14-12(13)16/h3-7,9H,1-2H3,(H2,13,16)/b14-10-