2-methylpropyl 2-[2-(aminocarbonylamino)-2-chloranylsulfinyl-4-oxidanylidene-3-phenylmethoxy-azetidin-1-yl]-3-methyl-but-3-enoate

Systemtic Name: 2-methylpropyl 2-[2-(aminocarbonylamino)-2-chloranylsulfinyl-4-oxidanylidene-3-phenylmethoxy-azetidin-1-yl]-3-methyl-but-3-enoate Openeye Name: isobutyl 2-(3-benzyloxy-2-chlorosulfinyl-4-oxo-2-ureido-azetidin-1-yl)-3-methyl-but-3-enoate CAS Name: 2-[2-(carbamoylamino)-2-chlorosulfinyl-4-oxo-3-phenylmethoxy-1-azetidinyl]-3-methyl-3-butenoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-[2-(carbamoylamino)-2-chlorosulfinyl-4-oxo-3-phenylmethoxyazetidin-1-yl]-3-methylbut-3-enoate Traditional Name: 2-(3-benzoxy-2-chlorosulfinyl-4-keto-2-ureido-azetidin-1-yl)-3-methyl-but-3-enoic acid isobutyl ester Formula: C20H26ClN3O6S MolecularWeight: 471.95494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C(C(=C)C)N1C(=O)C(C1(NC(=O)N)S(=O)Cl)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)COC(=O)C(C(=C)C)N1C(=O)C(C1(NC(=O)N)S(=O)Cl)OCC2=CC=CC=C2

InChI

InChI=1S/C20H26ClN3O6S/c1-12(2)10-30-18(26)15(13(3)4)24-17(25)16(20(24,31(21)28)23-19(22)27)29-11-14-8-6-5-7-9-14/h5-9,12,15-16H,3,10-11H2,1-2,4H3,(H3,22,23,27)