(1-cyanoindolizin-2-yl)methyl 2-acetamido-1,3-thiazole-4-carboxylate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 2-acetamido-1,3-thiazole-4-carboxylate Openeye Name: (1-cyanoindolizin-2-yl)methyl 2-acetamidothiazole-4-carboxylate CAS Name: 2-acetamido-4-thiazolecarboxylic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 2-acetamido-1,3-thiazole-4-carboxylate Traditional Name: 2-acetamidothiazole-4-carboxylic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C16H12N4O3S MolecularWeight: 340.35648

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=CS1)C(=O)OCC2=CN3C=CC=CC3=C2C#N

Isomeric SMILES

CC(=O)NC1=NC(=CS1)C(=O)OCC2=CN3C=CC=CC3=C2C#N

InChI

InChI=1S/C16H12N4O3S/c1-10(21)18-16-19-13(9-24-16)15(22)23-8-11-7-20-5-3-2-4-14(20)12(11)6-17/h2-5,7,9H,8H2,1H3,(H,18,19,21)