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

Systemtic Name: (4-cyanophenyl)methyl 2-acetamido-1,3-thiazole-4-carboxylate Openeye Name: (4-cyanophenyl)methyl 2-acetamidothiazole-4-carboxylate CAS Name: 2-acetamido-4-thiazolecarboxylic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 2-acetamido-1,3-thiazole-4-carboxylate Traditional Name: 2-acetamidothiazole-4-carboxylic acid (4-cyanobenzyl) ester Formula: C14H11N3O3S MolecularWeight: 301.32044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=CS1)C(=O)OCC2=CC=C(C=C2)C#N

Isomeric SMILES

CC(=O)NC1=NC(=CS1)C(=O)OCC2=CC=C(C=C2)C#N

InChI

InChI=1S/C14H11N3O3S/c1-9(18)16-14-17-12(8-21-14)13(19)20-7-11-4-2-10(6-15)3-5-11/h2-5,8H,7H2,1H3,(H,16,17,18)