methyl 3-methyl-2-[2-[(5-methyl-1,2-oxazol-3-yl)sulfinamoyl]-4-oxidanylidene-3-(2-phenoxyethanoylamino)azetidin-1-yl]but-2-enoate

Systemtic Name: methyl 3-methyl-2-[2-[(5-methyl-1,2-oxazol-3-yl)sulfinamoyl]-4-oxidanylidene-3-(2-phenoxyethanoylamino)azetidin-1-yl]but-2-enoate Openeye Name: methyl 3-methyl-2-[2-(5-methylisoxazol-3-yl)sulfinamoyl-4-oxo-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]but-2-enoate CAS Name: 3-methyl-2-[2-[(5-methyl-3-isoxazolyl)sulfinamoyl]-4-oxo-3-[(1-oxo-2-phenoxyethyl)amino]-1-azetidinyl]-2-butenoic acid methyl ester IUPAC Name: methyl 3-methyl-2-[2-[(5-methyl-1,2-oxazol-3-yl)sulfinamoyl]-4-oxo-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]but-2-enoate Traditional Name: 2-[2-keto-4-(5-methylisoxazol-3-yl)sulfinamoyl-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]-3-methyl-but-2-enoic acid methyl ester Formula: C21H24N4O7S MolecularWeight: 476.50286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NS(=O)C2C(C(=O)N2C(=C(C)C)C(=O)OC)NC(=O)COC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=NO1)NS(=O)C2C(C(=O)N2C(=C(C)C)C(=O)OC)NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C21H24N4O7S/c1-12(2)18(21(28)30-4)25-19(27)17(20(25)33(29)24-15-10-13(3)32-23-15)22-16(26)11-31-14-8-6-5-7-9-14/h5-10,17,20H,11H2,1-4H3,(H,22,26)(H,23,24)