Vitas-M small molecule compound
7-(3-methoxy-2-propoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid
Catalog ID
STK407912
SMILES COc1cccc(c1OCCC)C1C=C(Nc2n1ncn2)C(=O)O
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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 C16H18N4O4 MW 330.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N4O4/c1-3-7-24-14-10(5-4-6-13(14)23-2)12-8-11(15(21)22)19-16-17-9-18-20(12)16/h4-6,8-9,12H,3,7H2,1-2H3,(H,21,22)(H,17,18,19)InChIKey
AINMOZDBBIFUAE-UHFFFAOYSA-NSynonyms
7(3methoxy2propoxyphenyl)17dihydro(124)triazolo(15a)pyrimidine5carboxylicacid
7(3methoxy2propoxyphenyl)47dihydro(124)triazolo(15a)pyrimidine5carboxylicacid
CCCOC1=C(C=CC=C1OC)C2C=C(N=C3N2NC=N3)C(=O)O
InChI=1SC16H18N4O4c137241410(54613(14)232)12811(15(21)22)19161791820(12)16h468912H37H212H3(H2122)(H171819)
MFCD11696169
ZINC000101347857
ZINC000101347859
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