Vitas-M small molecule compound

3-(4-chlorophenyl)-9-methyl-1,7-bis(2-oxopropyl)-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione

Catalog ID
STK857879
SMILES CC(=O)CN1N=C(Cn2c1nc1c2c(=O)n(c(=O)n1C)CC(=O)C)c1ccc(cc1)Cl

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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 C20H19ClN6O4 MW 442.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19ClN6O4/c1-11(28)8-26-18(30)16-17(24(3)20(26)31)22-19-25(16)10-15(23-27(19)9-12(2)29)13-4-6-14(21)7-5-13/h4-7H,8-10H2,1-3H3
InChIKey
LWKDQRCSXGUSGH-UHFFFAOYSA-N
Synonyms
922615-18-7
17BIS(2OXOPROPYL)3(4CHLOROPHENYL)9METHYL579TRIHYDRO4H124TRIAZINO(43H)PURINE68DIONE
3(4chlorophenyl)9methyl17bis(2oxopropyl)14dihydro(124)triazino(34f)purine68(7H9H)dione
3(4chlorophenyl)9methyl17bis(2oxopropyl)4Hpurino(87c)(124)triazine68dione
3(4CHLOROPHENYL)9METHYL17BIS(2OXOPROPYL)79DIHYDRO(124)TRIAZINO(34F)PURINE68(1H4H)DIONE
922615187
CC(=O)CN1C(=O)C2=C(N=C3N2CC(=NN3CC(=O)C)C4=CC=C(C=C4)Cl)N(C1=O)C
InChI=1SC20H19ClN6O4c111(28)82618(30)1617(24(3)20(26)31)221925(16)1015(2327(19)912(2)29)134614(21)7513h47H810H213H3
MFCD08014267
ZINC000009292061
ZINC09292061
ZINC9292061

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Available files

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