methyl 2-[2-chloranylsulfinyl-4-oxidanylidene-3-[[2-phenyl-2-(phenylmethoxycarbonylamino)ethanoyl]amino]azetidin-1-yl]but-3-enoate

Systemtic Name: methyl 2-[2-chloranylsulfinyl-4-oxidanylidene-3-[[2-phenyl-2-(phenylmethoxycarbonylamino)ethanoyl]amino]azetidin-1-yl]but-3-enoate Openeye Name: methyl 2-[3-[[2-(benzyloxycarbonylamino)-2-phenyl-acetyl]amino]-2-chlorosulfinyl-4-oxo-azetidin-1-yl]but-3-enoate CAS Name: 2-[2-chlorosulfinyl-4-oxo-3-[[1-oxo-2-phenyl-2-(phenylmethoxycarbonylamino)ethyl]amino]-1-azetidinyl]-3-butenoic acid methyl ester IUPAC Name: methyl 2-[2-chlorosulfinyl-4-oxo-3-[[2-phenyl-2-(phenylmethoxycarbonylamino)acetyl]amino]azetidin-1-yl]but-3-enoate Traditional Name: 2-[3-[[2-(benzyloxycarbonylamino)-2-phenyl-acetyl]amino]-2-chlorosulfinyl-4-keto-azetidin-1-yl]but-3-enoic acid methyl ester Formula: C24H24ClN3O7S MolecularWeight: 533.98126

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C=C)N1C(C(C1=O)NC(=O)C(C2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3)S(=O)Cl

Isomeric SMILES

COC(=O)C(C=C)N1C(C(C1=O)NC(=O)C(C2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3)S(=O)Cl

InChI

InChI=1S/C24H24ClN3O7S/c1-3-17(23(31)34-2)28-21(30)19(22(28)36(25)33)26-20(29)18(16-12-8-5-9-13-16)27-24(32)35-14-15-10-6-4-7-11-15/h3-13,17-19,22H,1,14H2,2H3,(H,26,29)(H,27,32)