2-(azepan-1-yl)-4-ethyl-7-oxidanylidene-[1,3]thiazolo[4,5-b]pyridine-6-carboxylic acid

Systemtic Name: 2-(azepan-1-yl)-4-ethyl-7-oxidanylidene-[1,3]thiazolo[4,5-b]pyridine-6-carboxylic acid Openeye Name: 2-(azepan-1-yl)-4-ethyl-7-oxo-thiazolo[4,5-b]pyridine-6-carboxylic acid CAS Name: 2-(1-azepanyl)-4-ethyl-7-oxo-6-thiazolo[4,5-b]pyridinecarboxylic acid IUPAC Name: 2-(azepan-1-yl)-4-ethyl-7-oxo-[1,3]thiazolo[4,5-b]pyridine-6-carboxylic acid Traditional Name: 2-(azepan-1-yl)-4-ethyl-7-keto-thiazolo[4,5-b]pyridine-6-carboxylic acid Formula: C15H19N3O3S MolecularWeight: 321.39466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1N=C(S2)N3CCCCCC3)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=C1N=C(S2)N3CCCCCC3)C(=O)O

InChI

InChI=1S/C15H19N3O3S/c1-2-17-9-10(14(20)21)11(19)12-13(17)16-15(22-12)18-7-5-3-4-6-8-18/h9H,2-8H2,1H3,(H,20,21)