methyl 2-[2-ethanoylsulfanyl-4-oxidanylidene-2-(2-phenoxyethanoylamino)azetidin-1-yl]-3-methyl-but-3-enoate

Systemtic Name: methyl 2-[2-ethanoylsulfanyl-4-oxidanylidene-2-(2-phenoxyethanoylamino)azetidin-1-yl]-3-methyl-but-3-enoate Openeye Name: methyl 2-[2-acetylsulfanyl-4-oxo-2-[(2-phenoxyacetyl)amino]azetidin-1-yl]-3-methyl-but-3-enoate CAS Name: 2-[2-(acetylthio)-4-oxo-2-[(1-oxo-2-phenoxyethyl)amino]-1-azetidinyl]-3-methyl-3-butenoic acid methyl ester IUPAC Name: methyl 2-[2-acetylsulfanyl-4-oxo-2-[(2-phenoxyacetyl)amino]azetidin-1-yl]-3-methylbut-3-enoate Traditional Name: 2-[2-(acetylthio)-4-keto-2-[(2-phenoxyacetyl)amino]azetidin-1-yl]-3-methyl-but-3-enoic acid methyl ester Formula: C19H22N2O6S MolecularWeight: 406.45278

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(C(=O)OC)N1C(=O)CC1(NC(=O)COC2=CC=CC=C2)SC(=O)C

Isomeric SMILES

CC(=C)C(C(=O)OC)N1C(=O)CC1(NC(=O)COC2=CC=CC=C2)SC(=O)C

InChI

InChI=1S/C19H22N2O6S/c1-12(2)17(18(25)26-4)21-16(24)10-19(21,28-13(3)22)20-15(23)11-27-14-8-6-5-7-9-14/h5-9,17H,1,10-11H2,2-4H3,(H,20,23)