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CAS Number: 1025813-81-3
2-methylthieno[3,4-d]thiazole

Structure

2-methylthieno[3,4-d]thiazole
Name: 2-methylthieno[3,4-d]thiazole
Synonyms:
General Information
Product Number: 1025813813
CAS Registry Number: 1025813-81-3
Name:
        Thieno[3,​4-​d]​thiazole, 2-​methyl-
 
Chemical Formula: C6H5NS2
Exact Mass: 154.99
Molecular Weight: 155.24
m/z: 154.99 (100.0%), 156.98 (9.0%), 155.99 (8.1%)
Elemental Analysis: C, 46.42; H, 3.25; N, 9.02; S, 41.31
 
InChI: InChI=1S/C23H28ClN3O5S/c1-32-21-12-9-17(24)15-20(21)22(28)25-14-13-16-7-10-19(11-8-16)33(30,31)27-23(29)26-18-5-3-2-4-6-18/h7-12,15,18H,2-6,13-14H2,1H3,(H,25,28)(H2,26,27,29)
InChIKey: ZNNLBTZKUZBEKO-UHFFFAOYSA-N
Canonical SMILES : COC1=C(C=C(C=C1)Cl)C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)NC(=O)NC3CCCCC3

Specification

98%

References

PCT Int. Appl. (2011), WO 2011111683 A1 20110915.

Jpn. Kokai Tokkyo Koho (2011), JP 2011184353 A 20110922.                                  

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