Vitas-M small molecule compound
[6-(4-methylphenyl)-2,5-dioxo-2,5,6,7-tetrahydro-3H-imidazo[1,5-b][1,2,4]triazol-3-yl]acetonitrile
Catalog ID
STK656403
SMILES N#CCn1c(=O)nc2n1C(=O)N(C2)c1ccc(cc1)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 C13H11N5O2 MW 269.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11N5O2/c1-9-2-4-10(5-3-9)16-8-11-15-12(19)17(7-6-14)18(11)13(16)20/h2-5H,7-8H2,1H3InChIKey
RURHNIOCPMNBCM-UHFFFAOYSA-NSynonyms
1190285-21-2(6(4methylphenyl)25dioxo2567tetrahydro3Himidazo(15b)(124)triazol3yl)acetonitrile
1190285212
2(6(4methylphenyl)25dioxo7Himidazo(15b)(124)triazol3yl)acetonitrile
CC1=CC=C(C=C1)N2CC3=NC(=O)N(N3C2=O)CC#N
InChI=1SC13H11N5O2c192410(539)168111512(19)17(7614)18(11)13(16)20h25H78H21H3
MFCD13760338
ZINC000036365335
ZINC36365335
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