Vitas-M small molecule compound
[3-(4-fluorophenyl)-7,9-dimethyl-6,8-dioxo-6,7,8,9-tetrahydro[1,2,4]triazino[3,4-f]purin-1(4H)-yl]acetic acid
Catalog ID
STK623975
SMILES Fc1ccc(cc1)C1=NN(CC(=O)O)c2n(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 C17H15FN6O4 MW 386.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15FN6O4/c1-21-14-13(15(27)22(2)17(21)28)23-7-11(9-3-5-10(18)6-4-9)20-24(8-12(25)26)16(23)19-14/h3-6H,7-8H2,1-2H3,(H,25,26)InChIKey
VDRSQKNFCQEVKM-UHFFFAOYSA-NSynonyms
923376-79-8(3(4fluorophenyl)79dimethyl68dioxo6789tetrahydro(124)triazino(34f)purin1(4H)yl)aceticacid
2(3(4fluorophenyl)79dimethyl68dioxo4Hpurino(87c)(124)triazin1yl)aceticacid
2(3(4FLUOROPHENYL)79DIMETHYL68DIOXO579TRIHYDRO4H124TRIAZINO(43H)PURINYL)ACETICACID
2(3(4fluorophenyl)79dimethyl68dioxo6789tetrahydro(124)triazino(34f)purin1(4H)yl)aceticacid
923376798
CN1C2=C(C(=O)N(C1=O)C)N3CC(=NN(C3=N2)CC(=O)O)C4=CC=C(C=C4)F
InChI=1SC17H15FN6O4c1211413(15(27)22(2)17(21)28)23711(93510(18)649)2024(812(25)26)16(23)1914h36H78H212H3(H2526)
MFCD08997481
ZINC000008992954
ZINC8992954
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