Vitas-M small molecule compound
3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-[1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1H-pyrazol-3-yl]benzamide
Catalog ID
STK302777
SMILES O=C(c1cccc(c1)Cn1nc(c(c1C)[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 C26H30N6O3 MW 474.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N6O3/c1-16-24(32(34)35)17(2)30(28-16)15-18-4-3-5-22(11-18)25(33)27-23-6-7-31(29-23)26-12-19-8-20(13-26)10-21(9-19)14-26/h3-7,11,19-21H,8-10,12-15H2,1-2H3,(H,27,29,33)InChIKey
OUSJZIOSBQOVFN-UHFFFAOYSA-NSynonyms
957490-95-83((35dimethyl4nitro1Hpyrazol1yl)methyl)N(1(tricyclo(3311~37~)dec1yl)1Hpyrazol3yl)benzamide
957490958
CC1=C(C(=NN1CC2=CC=CC(=C2)C(=O)NC3=NN(C=C3)C45CC6CC(C4)CC(C6)C5)C)(N+)(=O)(O)
InChI=1SC26H30N6O3c11624(32(34)35)17(2)30(2816)151843522(1118)25(33)27236731(2923)261219820(1326)1021(919)1426h37111921H8101215H212H3(H272933)
MFCD04048380
N(1(1ADAMANTYL)1HPYRAZOL3YL)3((4NITRO35DIMETHYL1HPYRAZOL1YL)METHYL)BENZAMIDE
N(1(1ADAMANTYL)PYRAZOL3YL)3((35DIMETHYL4NITROPYRAZOL1YL)METHYL)BENZAMIDE
O=C(c1cccc(c1)Cn1nc(c(c1C)(N+)(=O)(O))C)Nc1ccn(n1)C12CC3CC(C2)CC(C1)C3
ZINC000008455645
ZINC08455645
ZINC8455645
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.