methyl 3-ethanoylsulfanyl-2-[[4-[(E)-hydroxyiminomethyl]phenyl]carbamoylamino]propanoate

Systemtic Name: methyl 3-ethanoylsulfanyl-2-[[4-[(E)-hydroxyiminomethyl]phenyl]carbamoylamino]propanoate Openeye Name: methyl 3-acetylsulfanyl-2-[[4-[(E)-hydroxyiminomethyl]phenyl]carbamoylamino]propanoate CAS Name: 3-(acetylthio)-2-[[[4-[(E)-hydroxyiminomethyl]anilino]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-acetylsulfanyl-2-[[4-[(E)-hydroxyiminomethyl]phenyl]carbamoylamino]propanoate Traditional Name: 3-(acetylthio)-2-[[4-[(E)-hydroximinomethyl]phenyl]carbamoylamino]propionic acid methyl ester Formula: C14H17N3O5S MolecularWeight: 339.36688

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(C(=O)OC)NC(=O)NC1=CC=C(C=C1)C=NO

Isomeric SMILES

CC(=O)SCC(C(=O)OC)NC(=O)NC1=CC=C(C=C1)/C=N/O

InChI

InChI=1S/C14H17N3O5S/c1-9(18)23-8-12(13(19)22-2)17-14(20)16-11-5-3-10(4-6-11)7-15-21/h3-7,12,21H,8H2,1-2H3,(H2,16,17,20)/b15-7+