Vitas-M small molecule compound
1-methyl-4-nitro-N-[1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1H-pyrazol-3-yl]-1H-pyrazole-3-carboxamide
Catalog ID
STK302387
SMILES O=C(c1nn(cc1[N+](=O)[O-])C)Nc1ccn(n1)C12CC3CC(C2)CC(C1)C3
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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 C18H22N6O3 MW 370.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N6O3/c1-22-10-14(24(26)27)16(21-22)17(25)19-15-2-3-23(20-15)18-7-11-4-12(8-18)6-13(5-11)9-18/h2-3,10-13H,4-9H2,1H3,(H,19,20,25)InChIKey
DSDQUPWQEWGEMI-UHFFFAOYSA-NSynonyms
512823-91-51methyl4nitroN(1(tricyclo(3311~37~)dec1yl)1Hpyrazol3yl)1Hpyrazole3carboxamide
512823915
CN1C=C(C(=N1)C(=O)NC2=NN(C=C2)C34CC5CC(C3)CC(C5)C4)(N+)(=O)(O)
InChI=1SC18H22N6O3c1221014(24(26)27)16(2122)17(25)19152323(2015)18711412(818)613(511)918h231013H49H21H3(H192025)
MFCD03468454
N(1(1ADAMANTYL)1HPYRAZOL3YL)4NITRO1METHYL1HPYRAZOLE3CARBOXAMIDE
N(1(1ADAMANTYL)PYRAZOL3YL)1METHYL4NITROPYRAZOLE3CARBOXAMIDE
O=C(c1nn(cc1(N+)(=O)(O))C)Nc1ccn(n1)C12CC3CC(C2)CC(C1)C3
ZINC000004652168
ZINC04652168
ZINC4652168
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