[2-[2-(furan-2-ylcarbonyl)hydrazinyl]-2-oxidanylidene-ethyl] 3-(4-methylphenyl)sulfanylpropanoate

Systemtic Name: [2-[2-(furan-2-ylcarbonyl)hydrazinyl]-2-oxidanylidene-ethyl] 3-(4-methylphenyl)sulfanylpropanoate Openeye Name: [2-[2-(furan-2-carbonyl)hydrazino]-2-oxo-ethyl] 3-(p-tolylsulfanyl)propanoate CAS Name: 3-[(4-methylphenyl)thio]propanoic acid [2-[[2-furanyl(oxo)methyl]hydrazo]-2-oxoethyl] ester IUPAC Name: [2-[2-(furan-2-carbonyl)hydrazinyl]-2-oxoethyl] 3-(4-methylphenyl)sulfanylpropanoate Traditional Name: 3-(p-tolylthio)propionic acid [2-[N'-(2-furoyl)hydrazino]-2-keto-ethyl] ester Formula: C17H18N2O5S MolecularWeight: 362.40022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCC(=O)OCC(=O)NNC(=O)C2=CC=CO2

Isomeric SMILES

CC1=CC=C(C=C1)SCCC(=O)OCC(=O)NNC(=O)C2=CC=CO2

InChI

InChI=1S/C17H18N2O5S/c1-12-4-6-13(7-5-12)25-10-8-16(21)24-11-15(20)18-19-17(22)14-3-2-9-23-14/h2-7,9H,8,10-11H2,1H3,(H,18,20)(H,19,22)