methyl 2-[2-methylsulfanyl-4-oxidanylidene-3-(2-thiophen-2-ylethanoylamino)azetidin-1-yl]-2-phenyl-ethanoate

Systemtic Name: methyl 2-[2-methylsulfanyl-4-oxidanylidene-3-(2-thiophen-2-ylethanoylamino)azetidin-1-yl]-2-phenyl-ethanoate Openeye Name: methyl 2-[2-methylsulfanyl-4-oxo-3-[[2-(2-thienyl)acetyl]amino]azetidin-1-yl]-2-phenyl-acetate CAS Name: 2-[2-(methylthio)-4-oxo-3-[(1-oxo-2-thiophen-2-ylethyl)amino]-1-azetidinyl]-2-phenylacetic acid methyl ester IUPAC Name: methyl 2-[2-methylsulfanyl-4-oxo-3-[(2-thiophen-2-ylacetyl)amino]azetidin-1-yl]-2-phenylacetate Traditional Name: 2-[2-keto-4-(methylthio)-3-[[2-(2-thienyl)acetyl]amino]azetidin-1-yl]-2-phenyl-acetic acid methyl ester Formula: C19H20N2O4S2 MolecularWeight: 404.5031

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1)N2C(C(C2=O)NC(=O)CC3=CC=CS3)SC

Isomeric SMILES

COC(=O)C(C1=CC=CC=C1)N2C(C(C2=O)NC(=O)CC3=CC=CS3)SC

InChI

InChI=1S/C19H20N2O4S2/c1-25-19(24)16(12-7-4-3-5-8-12)21-17(23)15(18(21)26-2)20-14(22)11-13-9-6-10-27-13/h3-10,15-16,18H,11H2,1-2H3,(H,20,22)