methyl 3-methyl-2-[2-(2-nitrophenyl)sulfonylsulfanyl-4-oxidanylidene-3-(2-phenylethanoylamino)azetidin-1-yl]but-3-enoate

Systemtic Name: methyl 3-methyl-2-[2-(2-nitrophenyl)sulfonylsulfanyl-4-oxidanylidene-3-(2-phenylethanoylamino)azetidin-1-yl]but-3-enoate Openeye Name: methyl 3-methyl-2-[2-(2-nitrophenyl)sulfonylsulfanyl-4-oxo-3-[(2-phenylacetyl)amino]azetidin-1-yl]but-3-enoate CAS Name: 3-methyl-2-[2-[(2-nitrophenyl)sulfonylthio]-4-oxo-3-[(1-oxo-2-phenylethyl)amino]-1-azetidinyl]-3-butenoic acid methyl ester IUPAC Name: methyl 3-methyl-2-[2-(2-nitrophenyl)sulfonylsulfanyl-4-oxo-3-[(2-phenylacetyl)amino]azetidin-1-yl]but-3-enoate Traditional Name: 2-[2-keto-4-[(2-nitrophenyl)sulfonylthio]-3-[(2-phenylacetyl)amino]azetidin-1-yl]-3-methyl-but-3-enoic acid methyl ester Formula: C23H23N3O8S2 MolecularWeight: 533.57402

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(C(=O)OC)N1C(C(C1=O)NC(=O)CC2=CC=CC=C2)SS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC(=C)C(C(=O)OC)N1C(C(C1=O)NC(=O)CC2=CC=CC=C2)SS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C23H23N3O8S2/c1-14(2)20(23(29)34-3)25-21(28)19(24-18(27)13-15-9-5-4-6-10-15)22(25)35-36(32,33)17-12-8-7-11-16(17)26(30)31/h4-12,19-20,22H,1,13H2,2-3H3,(H,24,27)