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CAS Number: 946198-89-6
tert-butyl 4-chloro-5,6-dihydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(8H)-carboxylate

Structure

 tert-butyl 4-chloro-5,6-dihydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(8H)-carboxylate
Name: tert-butyl 4-chloro-5,6-dihydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(8H)-carboxylate
Synonyms:
General Information
Product Number: 946198896

CAS Registry Number 946198-89-6
Name:
Pyrido[4',?3':4,?5]?thieno[2,?3-?d]?pyrimidine-?7(6H)?-?carboxylic acid, 4-?chloro-?5,?8-?dihydro-?, 1,?1-?dimethylethyl ester

 

Chemical Formula: C14H16ClN3O2S
Exact Mass: 325.07
Molecular Weight: 325.81
m/z: 325.07 (100.0%), 327.06 (36.5%), 326.07 (15.4%), 328.07 (5.0%), 326.06 (1.9%), 327.07 (1.8%), 329.06 (1.6%), 328.06 (1.3%)

 

InChI:InChI=1S/C14H16ClN3O2S/c1-14(2,3)20-13(19)18-5-4-8-9(6-18)21-12-10(8)11(15)16-7-17-12/h7H,4-6H2,1-3H3

InChI Key:GIBDUINSURSICA-UHFFFAOYSA-N

Canonical SMILES:CC(C)(C)OC(=O)N1CCC2=C(C1)SC3=C2C(=NC=N3)Cl

Specification

98%
References

(1) Wu, Chia-Hsien; Journal of Medicinal Chemistry 2010, V53(20), P7316-7326 CAPLUS
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