(2-acetamido-1,3-thiazol-4-yl)methyl quinoline-2-carboxylate

Systemtic Name: (2-acetamido-1,3-thiazol-4-yl)methyl quinoline-2-carboxylate Openeye Name: (2-acetamidothiazol-4-yl)methyl quinoline-2-carboxylate CAS Name: 2-quinolinecarboxylic acid (2-acetamido-4-thiazolyl)methyl ester IUPAC Name: (2-acetamido-1,3-thiazol-4-yl)methyl quinoline-2-carboxylate Traditional Name: quinaldic acid (2-acetamidothiazol-4-yl)methyl ester Formula: C16H13N3O3S MolecularWeight: 327.35772

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=CS1)COC(=O)C2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CC(=O)NC1=NC(=CS1)COC(=O)C2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C16H13N3O3S/c1-10(20)17-16-18-12(9-23-16)8-22-15(21)14-7-6-11-4-2-3-5-13(11)19-14/h2-7,9H,8H2,1H3,(H,17,18,20)