Vitas-M small molecule compound

ethyl 7-(4-chlorophenyl)-5-phenyl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate

Catalog ID
STL427059
SMILES CCOC(=O)C1=C(Nc2n(C1c1ccc(cc1)Cl)nnn2)c1ccccc1

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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 C19H16ClN5O2 MW 381.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16ClN5O2/c1-2-27-18(26)15-16(12-6-4-3-5-7-12)21-19-22-23-24-25(19)17(15)13-8-10-14(20)11-9-13/h3-11,17H,2H2,1H3,(H,21,22,24)
InChIKey
LJSUQQOCNIFEHZ-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(N=C2N=NNN2C1C3=CC=C(C=C3)Cl)C4=CC=CC=C4
ethyl7(4chlorophenyl)5phenyl17dihydrotetrazolo(15a)pyrimidine6carboxylate
ethyl7(4chlorophenyl)5phenyl47dihydrotetrazolo(15a)pyrimidine6carboxylate
InChI=1SC19H16ClN5O2c122718(26)1516(126435712)211922232425(19)17(15)1381014(20)11913h31117H2H21H3(H212224)
MFCD02370571
ZINC000005598123
ZINC000005598125

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Available files

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