Vitas-M small molecule compound

methyl 2-[1-(4-bromo-1H-pyrazol-1-yl)ethyl]-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate

Catalog ID
STL393508
SMILES COC(=O)c1sc2c(c1C)c1nc(nn1cn2)C(n1ncc(c1)Br)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C15H13BrN6O2S MW 421.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13BrN6O2S/c1-7-10-13-19-12(8(2)21-5-9(16)4-18-21)20-22(13)6-17-14(10)25-11(7)15(23)24-3/h4-6,8H,1-3H3
InChIKey
UCOGOVDTJQJUOM-UHFFFAOYSA-N
Synonyms
1005568-76-2
1005568762
CC1=C(SC2=C1C3=NC(=NN3C=N2)C(C)N4C=C(C=N4)Br)C(=O)OC
InChI=1SC15H13BrN6O2Sc1710131912(8(2)2159(16)41821)2022(13)61714(10)2511(7)15(23)243h468H13H3
METHYL2(1(4BROMO1HPYRAZOL1YL)ETHYL)9METHYLTHIENO(32E)(124)TRIAZOLO(15C)PYRIMIDINE8CARBOXYLATE
MFCD04134625
ZINC000002803923
ZINC000002803924

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.