Vitas-M small molecule compound

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

Catalog ID
STL395831
SMILES COC(=O)c1sc2c(c1C)c1nc(nn1cn2)c1nn(cc1I)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 C14H11IN6O2S MW 454.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11IN6O2S/c1-6-8-12-17-11(9-7(15)4-20(2)18-9)19-21(12)5-16-13(8)24-10(6)14(22)23-3/h4-5H,1-3H3
InChIKey
SQEKPXKMZVZMAR-UHFFFAOYSA-N
Synonyms
1005673-01-7
1005673017
CC1=C(SC2=C1C3=NC(=NN3C=N2)C4=NN(C=C4I)C)C(=O)OC
InChI=1SC14H11IN6O2Sc168121711(97(15)420(2)189)1921(12)51613(8)2410(6)14(22)233h45H13H3
METHYL2(4IODO1METHYL1HPYRAZOL3YL)9METHYLTHIENO(32E)(124)TRIAZOLO(15C)PYRIMIDINE8CARBOXYLATE
MFCD04132935
ZINC000002798636
ZINC02798636
ZINC2798636

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Available files

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