Vitas-M small molecule compound

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

Catalog ID
STK728593
SMILES COc1cccc(c1)C1C(=C(Nc2n1nnn2)C(=O)OC)C(=O)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 C15H15N5O4 MW 329.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15N5O4/c1-8(21)11-12(14(22)24-3)16-15-17-18-19-20(15)13(11)9-5-4-6-10(7-9)23-2/h4-7,13H,1-3H3,(H,16,17,19)
InChIKey
ONBCHFJFSVKGDN-UHFFFAOYSA-N
Synonyms
517889-00-8
517889008
CC(=O)C1=C(N=C2N=NNN2C1C3=CC(=CC=C3)OC)C(=O)OC
InChI=1SC15H15N5O4c18(21)1112(14(22)243)161517181920(15)13(11)954610(79)232h4713H13H3(H161719)
METHYL6ACETYL7(3METHOXYPHENYL)17DIHYDROTETRAZOLO(15A)PYRIMIDINE5CARBOXYLATE
methyl6acetyl7(3methoxyphenyl)47dihydrotetrazolo(15a)pyrimidine5carboxylate
MFCD03779550
ZINC000001417452
ZINC000001417453

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Available files

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