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

Systemtic Name: (4-methoxyphenyl)methyl 2-methyl-2-[2-oxidanylidene-3-(2-phenylethanoylamino)-4-(phenylsulfonylsulfanyl)azetidin-1-yl]but-3-enoate Openeye Name: (4-methoxyphenyl)methyl 2-[2-(benzenesulfonylsulfanyl)-4-oxo-3-[(2-phenylacetyl)amino]azetidin-1-yl]-2-methyl-but-3-enoate CAS Name: 2-[2-(benzenesulfonylthio)-4-oxo-3-[(1-oxo-2-phenylethyl)amino]-1-azetidinyl]-2-methyl-3-butenoic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl 2-[2-(benzenesulfonylsulfanyl)-4-oxo-3-[(2-phenylacetyl)amino]azetidin-1-yl]-2-methylbut-3-enoate Traditional Name: 2-[2-(besylthio)-4-keto-3-[(2-phenylacetyl)amino]azetidin-1-yl]-2-methyl-but-3-enoic acid p-anisyl ester Formula: C30H30N2O7S2 MolecularWeight: 594.6984

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=C)(C(=O)OCC1=CC=C(C=C1)OC)N2C(C(C2=O)NC(=O)CC3=CC=CC=C3)SS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C=C)(C(=O)OCC1=CC=C(C=C1)OC)N2C(C(C2=O)NC(=O)CC3=CC=CC=C3)SS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C30H30N2O7S2/c1-4-30(2,29(35)39-20-22-15-17-23(38-3)18-16-22)32-27(34)26(31-25(33)19-21-11-7-5-8-12-21)28(32)40-41(36,37)24-13-9-6-10-14-24/h4-18,26,28H,1,19-20H2,2-3H3,(H,31,33)