Vitas-M small molecule compound

7,9-dimethyl-3-(4-methylphenyl)-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione

Catalog ID
STK784089
SMILES Cc1ccc(cc1)C1=NNc2n(C1)c1c(=O)n(C)c(=O)n(c1n2)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 C16H16N6O2 MW 324.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N6O2/c1-9-4-6-10(7-5-9)11-8-22-12-13(17-15(22)19-18-11)20(2)16(24)21(3)14(12)23/h4-7H,8H2,1-3H3,(H,17,19)
InChIKey
OQUDYSJGXFOLNJ-UHFFFAOYSA-N
Synonyms

79dimethyl3(4methylphenyl)14dihydro(124)triazino(34f)purine68(7H9H)dione
79DIMETHYL3(4METHYLPHENYL)14DIHYDROPURINO(87C)(124)TRIAZINE68DIONE
CC1=CC=C(C=C1)C2=NNC3=NC4=C(N3C2)C(=O)N(C(=O)N4C)C
InChI=1SC16H16N6O2c194610(759)118221213(1715(22)191811)20(2)16(24)21(3)14(12)23h47H8H213H3(H1719)
MFCD06619429
ZINC000004626217
ZINC04626217
ZINC4626217

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Available files

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