Vitas-M small molecule compound
N-[2-(3,4-dimethoxyphenyl)ethyl]-5-(4-nitrophenyl)-1H-pyrazole-4-carboxamide
Catalog ID
STL184989
SMILES COc1ccc(cc1OC)CCNC(=O)c1cn[nH]c1c1ccc(cc1)[N+](=O)[O-]
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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 C20H20N4O5 MW 396.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O5/c1-28-17-8-3-13(11-18(17)29-2)9-10-21-20(25)16-12-22-23-19(16)14-4-6-15(7-5-14)24(26)27/h3-8,11-12H,9-10H2,1-2H3,(H,21,25)(H,22,23)InChIKey
OFSANVLNGKLXJF-UHFFFAOYSA-NSynonyms
COC1=C(C=C(C=C1)CCNC(=O)C2=C(NN=C2)C3=CC=C(C=C3)(N+)(=O)(O))OC
COc1ccc(cc1OC)CCNC(=O)c1cn(nH)c1c1ccc(cc1)(N+)(=O)(O)
InChI=1SC20H20N4O5c128178313(1118(17)292)9102120(25)1612222319(16)144615(7514)24(26)27h381112H910H212H3(H2125)(H2223)
MFCD22387131
N(2(34dimethoxyphenyl)ethyl)5(4nitrophenyl)1Hpyrazole4carboxamide
ZINC000072329407
ZINC72329407
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