(diphenylmethyl) (2R)-3-methyl-2-[(2R)-2-(4-methylphenyl)sulfonylsulfanyl-4-oxidanylidene-azetidin-1-yl]but-3-enoate

Systemtic Name: (diphenylmethyl) (2R)-3-methyl-2-[(2R)-2-(4-methylphenyl)sulfonylsulfanyl-4-oxidanylidene-azetidin-1-yl]but-3-enoate Openeye Name: benzhydryl (2R)-3-methyl-2-[(4R)-2-oxo-4-(p-tolylsulfonylsulfanyl)azetidin-1-yl]but-3-enoate CAS Name: (2R)-3-methyl-2-[(2R)-2-[(4-methylphenyl)sulfonylthio]-4-oxo-1-azetidinyl]-3-butenoic acid (diphenylmethyl) ester IUPAC Name: benzhydryl (2R)-3-methyl-2-[(2R)-2-(4-methylphenyl)sulfonylsulfanyl-4-oxoazetidin-1-yl]but-3-enoate Traditional Name: (2R)-2-[(4R)-2-keto-4-(tosylthio)azetidin-1-yl]-3-methyl-but-3-enoic acid benzhydryl ester Formula: C28H27NO5S2 MolecularWeight: 521.64768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)SC2CC(=O)N2C(C(=C)C)C(=O)OC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)S[C@@H]2CC(=O)N2[C@H](C(=C)C)C(=O)OC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H27NO5S2/c1-19(2)26(28(31)34-27(21-10-6-4-7-11-21)22-12-8-5-9-13-22)29-24(30)18-25(29)35-36(32,33)23-16-14-20(3)15-17-23/h4-17,25-27H,1,18H2,2-3H3/t25-,26-/m1/s1