pyridin-2-ylmethyl 3-methyl-6-thiophen-2-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxylate

Systemtic Name: pyridin-2-ylmethyl 3-methyl-6-thiophen-2-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxylate Openeye Name: 2-pyridylmethyl 3-methyl-6-(2-thienyl)isoxazolo[5,4-b]pyridine-4-carboxylate CAS Name: 3-methyl-6-thiophen-2-yl-4-isoxazolo[5,4-b]pyridinecarboxylic acid 2-pyridinylmethyl ester IUPAC Name: pyridin-2-ylmethyl 3-methyl-6-thiophen-2-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxylate Traditional Name: 3-methyl-6-(2-thienyl)isoxazolo[5,4-b]pyridine-4-carboxylic acid 2-pyridylmethyl ester Formula: C18H13N3O3S MolecularWeight: 351.37912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC2=C1C(=CC(=N2)C3=CC=CS3)C(=O)OCC4=CC=CC=N4

Isomeric SMILES

CC1=NOC2=C1C(=CC(=N2)C3=CC=CS3)C(=O)OCC4=CC=CC=N4

InChI

InChI=1S/C18H13N3O3S/c1-11-16-13(18(22)23-10-12-5-2-3-7-19-12)9-14(15-6-4-8-25-15)20-17(16)24-21-11/h2-9H,10H2,1H3