[2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] 3-phenylsulfanylpropanoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] 3-phenylsulfanylpropanoate Openeye Name: [2-(allylcarbamoylamino)-2-oxo-ethyl] 3-phenylsulfanylpropanoate CAS Name: 3-(phenylthio)propanoic acid [2-oxo-2-[[oxo-(prop-2-enylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-enylcarbamoylamino)ethyl] 3-phenylsulfanylpropanoate Traditional Name: 3-(phenylthio)propionic acid [2-(allylcarbamoylamino)-2-keto-ethyl] ester Formula: C15H18N2O4S MolecularWeight: 322.37942

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)NC(=O)COC(=O)CCSC1=CC=CC=C1

Isomeric SMILES

C=CCNC(=O)NC(=O)COC(=O)CCSC1=CC=CC=C1

InChI

InChI=1S/C15H18N2O4S/c1-2-9-16-15(20)17-13(18)11-21-14(19)8-10-22-12-6-4-3-5-7-12/h2-7H,1,8-11H2,(H2,16,17,18,20)