Vitas-M small molecule compound

pentyl 5-methyl-7-(pyridin-3-yl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate

Catalog ID
STL190902
SMILES CCCCCOC(=O)C1=C(C)Nc2n(C1c1cccnc1)nnn2

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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 C16H20N6O2 MW 328.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N6O2/c1-3-4-5-9-24-15(23)13-11(2)18-16-19-20-21-22(16)14(13)12-7-6-8-17-10-12/h6-8,10,14H,3-5,9H2,1-2H3,(H,18,19,21)
InChIKey
RYNXBQYOPQOLCQ-UHFFFAOYSA-N
Synonyms

CCCCCOC(=O)C1=C(N=C2N=NNN2C1C3=CN=CC=C3)C
InChI=1SC16H20N6O2c134592415(23)1311(2)181619202122(16)14(13)12768171012h681014H359H212H3(H181921)
MFCD22390115
pentyl5methyl7(pyridin3yl)47dihydrotetrazolo(15a)pyrimidine6carboxylate
pentyl5methyl7pyridin3yl17dihydrotetrazolo(15a)pyrimidine6carboxylate
ZINC000045896053
ZINC000045896054

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Available files

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