[2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 3-(2-chlorophenyl)sulfanylpropanoate

Systemtic Name: [2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 3-(2-chlorophenyl)sulfanylpropanoate Openeye Name: [2-(isopropylcarbamoylamino)-2-oxo-ethyl] 3-(2-chlorophenyl)sulfanylpropanoate CAS Name: 3-[(2-chlorophenyl)thio]propanoic acid [2-oxo-2-[[oxo-(propan-2-ylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 3-(2-chlorophenyl)sulfanylpropanoate Traditional Name: 3-[(2-chlorophenyl)thio]propionic acid [2-(isopropylcarbamoylamino)-2-keto-ethyl] ester Formula: C15H19ClN2O4S MolecularWeight: 358.84036

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)COC(=O)CCSC1=CC=CC=C1Cl

Isomeric SMILES

CC(C)NC(=O)NC(=O)COC(=O)CCSC1=CC=CC=C1Cl

InChI

InChI=1S/C15H19ClN2O4S/c1-10(2)17-15(21)18-13(19)9-22-14(20)7-8-23-12-6-4-3-5-11(12)16/h3-6,10H,7-9H2,1-2H3,(H2,17,18,19,21)