[2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 3-(3,4-dimethylphenyl)sulfanylpropanoate

Systemtic Name: [2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 3-(3,4-dimethylphenyl)sulfanylpropanoate Openeye Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 3-(3,4-dimethylphenyl)sulfanylpropanoate CAS Name: 3-[(3,4-dimethylphenyl)thio]propanoic acid [2-oxo-2-[[oxo(propylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 3-(3,4-dimethylphenyl)sulfanylpropanoate Traditional Name: 3-[(3,4-dimethylphenyl)thio]propionic acid [2-keto-2-(propylcarbamoylamino)ethyl] ester Formula: C17H24N2O4S MolecularWeight: 352.44846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24N2O4S/c1-4-8-18-17(22)19-15(20)11-23-16(21)7-9-24-14-6-5-12(2)13(3)10-14/h5-6,10H,4,7-9,11H2,1-3H3,(H2,18,19,20,22)