Vitas-M small molecule compound
[3,9-dimethyl-7-(2-methylpropyl)-6,8-dioxo-6,7,8,9-tetrahydro[1,2,4]triazino[3,4-f]purin-1(4H)-yl]acetic acid
Catalog ID
STL009041
SMILES CC(Cn1c(=O)n(C)c2c(c1=O)n1CC(=NN(c1n2)CC(=O)O)C)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 C15H20N6O4 MW 348.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H20N6O4/c1-8(2)5-20-13(24)11-12(18(4)15(20)25)16-14-19(11)6-9(3)17-21(14)7-10(22)23/h8H,5-7H2,1-4H3,(H,22,23)InChIKey
HCRQBVIKOCYKNR-UHFFFAOYSA-NSynonyms
919735-05-0(39dimethyl7(2methylpropyl)68dioxo6789tetrahydro(124)triazino(34f)purin1(4H)yl)aceticacid
2(39dimethyl7(2methylpropyl)68dioxo4Hpurino(87c)(124)triazin1yl)aceticacid
2(39DIMETHYL7(2METHYLPROPYL)68DIOXO579TRIHYDRO4H124TRIAZINO(43H)PURINYL)ACETICACID
2(7isobutyl39dimethyl68dioxo6789tetrahydro(124)triazino(34f)purin1(4H)yl)aceticacid
919735050
CC1=NN(C2=NC3=C(N2C1)C(=O)N(C(=O)N3C)CC(C)C)CC(=O)O
InChI=1SC15H20N6O4c18(2)52013(24)1112(18(4)15(20)25)161419(11)69(3)1721(14)710(22)23h8H57H214H3(H2223)
MFCD08542649
ZINC000009060163
ZINC9060163
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