CAS Registry Number 96516-52-8
Name:
Thieno[3,​2-​b]​pyridine-​6-​carboxylic acid, 7-​chloro-​, methyl ester

Chemical Formula: C9H6ClNO2S
Exact Mass: 226.98
Molecular Weight: 227.67
m/z: 226.98 (100.0%), 228.98 (36.6%), 227.98 (11.0%), 229.98 (3.9%), 230.97 (1.4%)

InChI: InChI=1S/C9H6ClNO2S/c1-13-9(12)5-4-11-6-2-3-14-8(6)7(5)10/h2-4H,1H3
InChIKey: XMAAPCRARDHOKI-UHFFFAOYSA-N
Canonical SMILES : COC(=O)C1=CN=C2C=CSC2=C1Cl

Specification

98%

1. (1) Forbes, Ian T.; Journal of Medicinal Chemistry 1990, V33(9), P2640-5 CAPLUS