methyl 2-(3-azido-2-oxidanylidene-4-phenyl-azetidin-1-yl)-4-methylsulfanyl-butanoate

Systemtic Name: methyl 2-(3-azido-2-oxidanylidene-4-phenyl-azetidin-1-yl)-4-methylsulfanyl-butanoate Openeye Name: methyl 2-(3-azido-2-oxo-4-phenyl-azetidin-1-yl)-4-methylsulfanyl-butanoate CAS Name: 2-(3-azido-2-oxo-4-phenyl-1-azetidinyl)-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-(3-azido-2-oxo-4-phenylazetidin-1-yl)-4-methylsulfanylbutanoate Traditional Name: 2-(3-azido-2-keto-4-phenyl-azetidin-1-yl)-4-(methylthio)butyric acid methyl ester Formula: C15H18N4O3S MolecularWeight: 334.39342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)N1C(C(C1=O)N=[N+]=[N-])C2=CC=CC=C2

Isomeric SMILES

COC(=O)C(CCSC)N1C(C(C1=O)N=[N+]=[N-])C2=CC=CC=C2

InChI

InChI=1S/C15H18N4O3S/c1-22-15(21)11(8-9-23-2)19-13(10-6-4-3-5-7-10)12(14(19)20)17-18-16/h3-7,11-13H,8-9H2,1-2H3