[2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] (2S)-2-(4-chlorophenyl)sulfanylpropanoate

Systemtic Name: [2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] (2S)-2-(4-chlorophenyl)sulfanylpropanoate Openeye Name: [2-(isopropylcarbamoylamino)-2-oxo-ethyl] (2S)-2-(4-chlorophenyl)sulfanylpropanoate CAS Name: (2S)-2-[(4-chlorophenyl)thio]propanoic acid [2-oxo-2-[[oxo-(propan-2-ylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] (2S)-2-(4-chlorophenyl)sulfanylpropanoate Traditional Name: (2S)-2-[(4-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)C(C)SC1=CC=C(C=C1)Cl

Isomeric SMILES

C[C@@H](C(=O)OCC(=O)NC(=O)NC(C)C)SC1=CC=C(C=C1)Cl

InChI

InChI=1S/C15H19ClN2O4S/c1-9(2)17-15(21)18-13(19)8-22-14(20)10(3)23-12-6-4-11(16)5-7-12/h4-7,9-10H,8H2,1-3H3,(H2,17,18,19,21)/t10-/m0/s1