CAS Registry Number 83621-45-8
Name:
4H-​Thieno[2,​3-​d]​azepine-​2-​carboxylic acid, 5,​6,​7,​8-​tetrahydro-​6-​(phenylmethyl)​-​, ethyl ester

Chemical Formula: C18H21NO2S
Exact Mass: 315.13
Molecular Weight: 315.43
m/z: 315.13 (100.0%), 316.13 (20.7%), 317.13 (5.2%), 317.14 (1.9%)

InChI:InChI=1S/C18H21NO2S/c1-2-21-18(20)17-12-15-8-10-19(11-9-16(15)22-17)13-14-6-4-3-5-7-14/h3-7,12H,2,8-11,13H2,1H3

InChI Key:NVUIKIQDZRMQBL-UHFFFAOYSA-N

Canonical SMILES:CCOC(=O)C1=CC2=C(S1)CCN(CC2)CC3=CC=CC=C3

Specification

98%

Ger. Offen. (1982), DE 3105858 A1 19820902.