[(2S)-1-(methylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 4-(4-chlorophenyl)sulfanylbutanoate

Systemtic Name: [(2S)-1-(methylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 4-(4-chlorophenyl)sulfanylbutanoate Openeye Name: [(1S)-1-methyl-2-(methylcarbamoylamino)-2-oxo-ethyl] 4-(4-chlorophenyl)sulfanylbutanoate CAS Name: 4-[(4-chlorophenyl)thio]butanoic acid [(2S)-1-(methylcarbamoylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(methylcarbamoylamino)-1-oxopropan-2-yl] 4-(4-chlorophenyl)sulfanylbutanoate Traditional Name: 4-[(4-chlorophenyl)thio]butyric acid [(1S)-2-keto-1-methyl-2-(methylcarbamoylamino)ethyl] ester Formula: C15H19ClN2O4S MolecularWeight: 358.84036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC)OC(=O)CCCSC1=CC=C(C=C1)Cl

Isomeric SMILES

C[C@@H](C(=O)NC(=O)NC)OC(=O)CCCSC1=CC=C(C=C1)Cl

InChI

InChI=1S/C15H19ClN2O4S/c1-10(14(20)18-15(21)17-2)22-13(19)4-3-9-23-12-7-5-11(16)6-8-12/h5-8,10H,3-4,9H2,1-2H3,(H2,17,18,20,21)/t10-/m0/s1