2-[(2S,3S)-2-methyl-4-oxidanylidene-3-(2-phenylethanoylamino)azetidin-1-yl]sulfanylethanoic acid

Systemtic Name: 2-[(2S,3S)-2-methyl-4-oxidanylidene-3-(2-phenylethanoylamino)azetidin-1-yl]sulfanylethanoic acid Openeye Name: 2-[(2S,3S)-2-methyl-4-oxo-3-[(2-phenylacetyl)amino]azetidin-1-yl]sulfanylacetic acid CAS Name: 2-[[(2S,3S)-2-methyl-4-oxo-3-[(1-oxo-2-phenylethyl)amino]-1-azetidinyl]thio]acetic acid IUPAC Name: 2-[(2S,3S)-2-methyl-4-oxo-3-[(2-phenylacetyl)amino]azetidin-1-yl]sulfanylacetic acid Traditional Name: 2-[[(3S,4S)-2-keto-4-methyl-3-[(2-phenylacetyl)amino]azetidin-1-yl]thio]acetic acid Formula: C14H16N2O4S MolecularWeight: 308.35284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(=O)N1SCC(=O)O)NC(=O)CC2=CC=CC=C2

Isomeric SMILES

C[C@H]1[C@@H](C(=O)N1SCC(=O)O)NC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C14H16N2O4S/c1-9-13(14(20)16(9)21-8-12(18)19)15-11(17)7-10-5-3-2-4-6-10/h2-6,9,13H,7-8H2,1H3,(H,15,17)(H,18,19)/t9-,13-/m0/s1