diethyl 2-acetamido-2-[[3-ethoxy-5-(1,3-thiazol-2-yl)-1,2-oxazol-4-yl]methyl]propanedioate

Systemtic Name: diethyl 2-acetamido-2-[[3-ethoxy-5-(1,3-thiazol-2-yl)-1,2-oxazol-4-yl]methyl]propanedioate Openeye Name: diethyl 2-acetamido-2-[(3-ethoxy-5-thiazol-2-yl-isoxazol-4-yl)methyl]propanedioate CAS Name: 2-acetamido-2-[[3-ethoxy-5-(2-thiazolyl)-4-isoxazolyl]methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-[[3-ethoxy-5-(1,3-thiazol-2-yl)-1,2-oxazol-4-yl]methyl]propanedioate Traditional Name: 2-acetamido-2-[(3-ethoxy-5-thiazol-2-yl-isoxazol-4-yl)methyl]malonic acid diethyl ester Formula: C18H23N3O7S MolecularWeight: 425.45612

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NOC(=C1CC(C(=O)OCC)(C(=O)OCC)NC(=O)C)C2=NC=CS2

Isomeric SMILES

CCOC1=NOC(=C1CC(C(=O)OCC)(C(=O)OCC)NC(=O)C)C2=NC=CS2

InChI

InChI=1S/C18H23N3O7S/c1-5-25-14-12(13(28-21-14)15-19-8-9-29-15)10-18(20-11(4)22,16(23)26-6-2)17(24)27-7-3/h8-9H,5-7,10H2,1-4H3,(H,20,22)