Vitas-M small molecule compound

(1,5-dimethyl-4-nitro-1H-pyrazol-3-yl)[3,5-dimethyl-4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1H-pyrazol-1-yl]methanone

Catalog ID
STK303280
SMILES Cc1nn(c(c1C12CC3CC(C2)CC(C1)C3)C)C(=O)c1nn(c(c1[N+](=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 C21H27N5O3 MW 397.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N5O3/c1-11-17(21-8-14-5-15(9-21)7-16(6-14)10-21)12(2)25(22-11)20(27)18-19(26(28)29)13(3)24(4)23-18/h14-16H,5-10H2,1-4H3
InChIKey
KRWOLDCCYQTANU-UHFFFAOYSA-N
Synonyms
1005576-83-9
(15dimethyl4nitro1Hpyrazol3yl)(35dimethyl4(tricyclo(3311~37~)dec1yl)1Hpyrazol1yl)methanone
(4(1ADAMANTYL)35DIMETHYLPYRAZOL1YL)(15DIMETHYL4NITROPYRAZOL3YL)METHANONE
1005576839
CC1=C(C(=NN1C(=O)C2=NN(C(=C2(N+)(=O)(O))C)C)C)C34CC5CC(C3)CC(C5)C4
Cc1nn(c(c1C12CC3CC(C2)CC(C1)C3)C)C(=O)c1nn(c(c1(N+)(=O)(O))C)C
InChI=1SC21H27N5O3c11117(21814515(921)716(614)1021)12(2)25(2211)20(27)1819(26(28)29)13(3)24(4)2318h1416H510H214H3
MFCD04043539
ZINC000006525964
ZINC06525964
ZINC6525964

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Available files

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