(4-acetamidophenyl) 2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carboxylate

Systemtic Name: (4-acetamidophenyl) 2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carboxylate Openeye Name: (4-acetamidophenyl) 2-[(5-methylisoxazol-3-yl)methylsulfanyl]pyridine-3-carboxylate CAS Name: 2-[(5-methyl-3-isoxazolyl)methylthio]-3-pyridinecarboxylic acid (4-acetamidophenyl) ester IUPAC Name: (4-acetamidophenyl) 2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carboxylate Traditional Name: 2-[(5-methylisoxazol-3-yl)methylthio]nicotinic acid (4-acetamidophenyl) ester Formula: C19H17N3O4S MolecularWeight: 383.42098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CSC2=C(C=CC=N2)C(=O)OC3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CC1=CC(=NO1)CSC2=C(C=CC=N2)C(=O)OC3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C19H17N3O4S/c1-12-10-15(22-26-12)11-27-18-17(4-3-9-20-18)19(24)25-16-7-5-14(6-8-16)21-13(2)23/h3-10H,11H2,1-2H3,(H,21,23)