methyl 3-[(1S)-2-(ethylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl]sulfanylpropanoate

Systemtic Name: methyl 3-[(1S)-2-(ethylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl]sulfanylpropanoate Openeye Name: methyl 3-[(1S)-2-(ethylcarbamoylamino)-2-oxo-1-phenyl-ethyl]sulfanylpropanoate CAS Name: 3-[[(1S)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[(1S)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethyl]sulfanylpropanoate Traditional Name: 3-[[(1S)-2-(ethylcarbamoylamino)-2-keto-1-phenyl-ethyl]thio]propionic acid methyl ester Formula: C15H20N2O4S MolecularWeight: 324.3953

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(C1=CC=CC=C1)SCCC(=O)OC

Isomeric SMILES

CCNC(=O)NC(=O)[C@H](C1=CC=CC=C1)SCCC(=O)OC

InChI

InChI=1S/C15H20N2O4S/c1-3-16-15(20)17-14(19)13(11-7-5-4-6-8-11)22-10-9-12(18)21-2/h4-8,13H,3,9-10H2,1-2H3,(H2,16,17,19,20)/t13-/m0/s1