[(2S)-1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl] 2-(4-methoxyphenyl)sulfanylethanoate

Systemtic Name: [(2S)-1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl] 2-(4-methoxyphenyl)sulfanylethanoate Openeye Name: [(1S)-1-methyl-2-oxo-2-ureido-ethyl] 2-(4-methoxyphenyl)sulfanylacetate CAS Name: 2-[(4-methoxyphenyl)thio]acetic acid [(2S)-1-(carbamoylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(carbamoylamino)-1-oxopropan-2-yl] 2-(4-methoxyphenyl)sulfanylacetate Traditional Name: 2-[(4-methoxyphenyl)thio]acetic acid [(1S)-2-keto-1-methyl-2-ureido-ethyl] ester Formula: C13H16N2O5S MolecularWeight: 312.34154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)N)OC(=O)CSC1=CC=C(C=C1)OC

Isomeric SMILES

C[C@@H](C(=O)NC(=O)N)OC(=O)CSC1=CC=C(C=C1)OC

InChI

InChI=1S/C13H16N2O5S/c1-8(12(17)15-13(14)18)20-11(16)7-21-10-5-3-9(19-2)4-6-10/h3-6,8H,7H2,1-2H3,(H3,14,15,17,18)/t8-/m0/s1