[(2S)-1-oxidanylidene-1-(propan-2-ylcarbamoylamino)propan-2-yl] 3-[[(E)-2-phenylethenyl]sulfonylamino]propanoate

Systemtic Name: [(2S)-1-oxidanylidene-1-(propan-2-ylcarbamoylamino)propan-2-yl] 3-[[(E)-2-phenylethenyl]sulfonylamino]propanoate Openeye Name: [(1S)-2-(isopropylcarbamoylamino)-1-methyl-2-oxo-ethyl] 3-[[(E)-styryl]sulfonylamino]propanoate CAS Name: 3-[[(E)-2-phenylethenyl]sulfonylamino]propanoic acid [(2S)-1-oxo-1-[[oxo-(propan-2-ylamino)methyl]amino]propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(propan-2-ylcarbamoylamino)propan-2-yl] 3-[[(E)-2-phenylethenyl]sulfonylamino]propanoate Traditional Name: 3-[[(E)-styryl]sulfonylamino]propionic acid [(1S)-2-(isopropylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C18H25N3O6S MolecularWeight: 411.4726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)C(C)OC(=O)CCNS(=O)(=O)C=CC1=CC=CC=C1

Isomeric SMILES

C[C@@H](C(=O)NC(=O)NC(C)C)OC(=O)CCNS(=O)(=O)/C=C/C1=CC=CC=C1

InChI

InChI=1S/C18H25N3O6S/c1-13(2)20-18(24)21-17(23)14(3)27-16(22)9-11-19-28(25,26)12-10-15-7-5-4-6-8-15/h4-8,10,12-14,19H,9,11H2,1-3H3,(H2,20,21,23,24)/b12-10+/t14-/m0/s1