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

Systemtic Name: (phenylmethyl) 3-methyl-2-[2-[(5-methyl-1,2-oxazol-3-yl)sulfinamoyl]-4-oxidanylidene-azetidin-1-yl]but-2-enoate Openeye Name: benzyl 3-methyl-2-[2-(5-methylisoxazol-3-yl)sulfinamoyl-4-oxo-azetidin-1-yl]but-2-enoate CAS Name: 3-methyl-2-[2-[(5-methyl-3-isoxazolyl)sulfinamoyl]-4-oxo-1-azetidinyl]-2-butenoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-methyl-2-[2-[(5-methyl-1,2-oxazol-3-yl)sulfinamoyl]-4-oxoazetidin-1-yl]but-2-enoate Traditional Name: 2-[2-keto-4-(5-methylisoxazol-3-yl)sulfinamoyl-azetidin-1-yl]-3-methyl-but-2-enoic acid benzyl ester Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NS(=O)C2CC(=O)N2C(=C(C)C)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=NO1)NS(=O)C2CC(=O)N2C(=C(C)C)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C19H21N3O5S/c1-12(2)18(19(24)26-11-14-7-5-4-6-8-14)22-16(23)10-17(22)28(25)21-15-9-13(3)27-20-15/h4-9,17H,10-11H2,1-3H3,(H,20,21)