methyl 4-acetyloxy-2-[3-ethanoyl-4-(pyridin-2-ylcarbamoyl)-1,3-thiazolidin-2-yl]benzoate

Systemtic Name: methyl 4-acetyloxy-2-[3-ethanoyl-4-(pyridin-2-ylcarbamoyl)-1,3-thiazolidin-2-yl]benzoate Openeye Name: methyl 4-acetoxy-2-[3-acetyl-4-(2-pyridylcarbamoyl)thiazolidin-2-yl]benzoate CAS Name: 2-[3-acetyl-4-[oxo-(2-pyridinylamino)methyl]-2-thiazolidinyl]-4-acetyloxybenzoic acid methyl ester IUPAC Name: methyl 4-acetyloxy-2-[3-acetyl-4-(pyridin-2-ylcarbamoyl)-1,3-thiazolidin-2-yl]benzoate Traditional Name: 4-acetoxy-2-[3-acetyl-4-(2-pyridylcarbamoyl)thiazolidin-2-yl]benzoic acid methyl ester Formula: C21H21N3O6S MolecularWeight: 443.47294

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(CSC1C2=C(C=CC(=C2)OC(=O)C)C(=O)OC)C(=O)NC3=CC=CC=N3

Isomeric SMILES

CC(=O)N1C(CSC1C2=C(C=CC(=C2)OC(=O)C)C(=O)OC)C(=O)NC3=CC=CC=N3

InChI

InChI=1S/C21H21N3O6S/c1-12(25)24-17(19(27)23-18-6-4-5-9-22-18)11-31-20(24)16-10-14(30-13(2)26)7-8-15(16)21(28)29-3/h4-10,17,20H,11H2,1-3H3,(H,22,23,27)