CAS Registry Number: 18366-59-1

Name:

Ethanone, 1-​thieno[3,​2-​b]​pyridin-​6-​yl-
Ketone, methyl thieno[3,​2-​b]​pyridin-​6-​yl (8CI); Thieno[3,​2-​b]​pyridine, ethanone deriv. 

Chemical Formula: C9H7NOS
Exact Mass: 177.02
Molecular Weight: 177.22
m/z: 177.02 (100.0%), 178.03 (9.9%), 179.02 (4.5%), 178.02 (1.2%)
Elemental Analysis: C, 60.99; H, 3.98; N, 7.90; O, 9.03; S, 18.09

InChI: InChI=1S/C9H7NOS/c1-6(11)7-4-9-8(10-5-7)2-3-12-9/h2-5H,1H3
InChIKey: XDOMVPLWPJTUMI-UHFFFAOYSA-N
Canonical SMILES : CC(=O)C1=CC2=C(C=CS2)N=C1

Specification

98%

1. (1) Cazin, J.; Tetrahedron 1988, V44(4), P1079-90 CAPLUS
2. (2) Klemm, L. H.; Journal of Heterocyclic Chemistry 1981, V18(7), P1383-7 CAPLUS