Vitas-M small molecule compound

methyl 7-(3-fluorophenyl)-6-(phenylcarbonyl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine-5-carboxylate

Catalog ID
STK770211
SMILES COC(=O)C1=C(C(=O)c2ccccc2)C(n2c(N1)nnn2)c1cccc(c1)F

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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 C19H14FN5O3 MW 379.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14FN5O3/c1-28-18(27)15-14(17(26)11-6-3-2-4-7-11)16(12-8-5-9-13(20)10-12)25-19(21-15)22-23-24-25/h2-10,16H,1H3,(H,21,22,24)
InChIKey
CCVXAZMTXFNXDA-UHFFFAOYSA-N
Synonyms

COC(=O)C1=C(C(N2C(=N1)N=NN2)C3=CC(=CC=C3)F)C(=O)C4=CC=CC=C4
InChI=1SC19H14FN5O3c12818(27)1514(17(26)116324711)16(1285913(20)1012)2519(2115)22232425h21016H1H3(H212224)
METHYL6BENZOYL7(3FLUOROPHENYL)17DIHYDROTETRAZOLO(15A)PYRIMIDINE5CARBOXYLATE
methyl7(3fluorophenyl)6(phenylcarbonyl)47dihydrotetrazolo(15a)pyrimidine5carboxylate
MFCD03764271
ZINC000000718980
ZINC000000718981

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Available files

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