Vitas-M small molecule compound
(7-benzyl-3,9-dimethyl-6,8-dioxo-6,7,8,9-tetrahydro[1,2,4]triazino[3,4-f]purin-1(4H)-yl)acetic acid
Catalog ID
STL008790
SMILES OC(=O)CN1N=C(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccccc1
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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 C18H18N6O4 MW 382.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N6O4/c1-11-8-22-14-15(19-17(22)24(20-11)10-13(25)26)21(2)18(28)23(16(14)27)9-12-6-4-3-5-7-12/h3-7H,8-10H2,1-2H3,(H,25,26)InChIKey
WSGRCINSBDGCLB-UHFFFAOYSA-NSynonyms
923468-57-9(7benzyl39dimethyl68dioxo6789tetrahydro(124)triazino(34f)purin1(4H)yl)aceticacid
2(39DIMETHYL68DIOXO7BENZYL579TRIHYDRO4H124TRIAZINO(43H)PURINYL)ACETICACID
2(7benzyl39dimethyl68dioxo4Hpurino(87c)(124)triazin1yl)aceticacid
2(7benzyl39dimethyl68dioxo6789tetrahydro(124)triazino(34f)purin1(4H)yl)aceticacid
923468579
CC1=NN(C2=NC3=C(N2C1)C(=O)N(C(=O)N3C)CC4=CC=CC=C4)CC(=O)O
InChI=1SC18H18N6O4c1118221415(1917(22)24(2011)1013(25)26)21(2)18(28)23(16(14)27)9126435712h37H810H212H3(H2526)
MFCD08998722
ZINC000009421492
ZINC9421492
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