Vitas-M small molecule compound
N-(1,3-benzodioxol-5-ylmethyl)-2-[(5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]benzamide
Catalog ID
STL402064
SMILES O=C(c1ccccc1Cn1nc(cc1C)[N+](=O)[O-])NCc1ccc2c(c1)OCO2
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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 C20H18N4O5 MW 394.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4O5/c1-13-8-19(24(26)27)22-23(13)11-15-4-2-3-5-16(15)20(25)21-10-14-6-7-17-18(9-14)29-12-28-17/h2-9H,10-12H2,1H3,(H,21,25)InChIKey
CSQKUONLYBDICX-UHFFFAOYSA-NSynonyms
1005651-95-51005651955
CC1=CC(=NN1CC2=CC=CC=C2C(=O)NCC3=CC4=C(C=C3)OCO4)(N+)(=O)(O)
InChI=1SC20H18N4O5c113819(24(26)27)2223(13)1115423516(15)20(25)211014671718(914)29122817h29H1012H21H3(H2125)
MFCD04131307
N(13benzodioxol5ylmethyl)2((5methyl3nitro1Hpyrazol1yl)methyl)benzamide
N(13benzodioxol5ylmethyl)2((5methyl3nitropyrazol1yl)methyl)benzamide
O=C(c1ccccc1Cn1nc(cc1C)(N+)(=O)(O))NCc1ccc2c(c1)OCO2
ZINC000002794532
ZINC02794532
ZINC2794532
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