Vitas-M small molecule compound
N-[1-(2-chloro-4-fluorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-1-ethyl-4-nitro-1H-pyrazole-3-carboxamide
Catalog ID
STK305213
SMILES CCn1cc(c(n1)C(=O)Nc1c(C)nn(c1C)Cc1ccc(cc1Cl)F)[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 C18H18ClFN6O3 MW 420.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClFN6O3/c1-4-24-9-15(26(28)29)17(23-24)18(27)21-16-10(2)22-25(11(16)3)8-12-5-6-13(20)7-14(12)19/h5-7,9H,4,8H2,1-3H3,(H,21,27)InChIKey
YSEUHRKINHZWFR-UHFFFAOYSA-NSynonyms
1005582-96-61005582966
CCN1C=C(C(=N1)C(=O)NC2=C(N(N=C2C)CC3=C(C=C(C=C3)F)Cl)C)(N+)(=O)(O)
CCn1cc(c(n1)C(=O)Nc1c(C)nn(c1C)Cc1ccc(cc1Cl)F)(N+)(=O)(O)
InChI=1SC18H18ClFN6O3c1424915(26(28)29)17(2324)18(27)211610(2)2225(11(16)3)8125613(20)714(12)19h579H48H213H3(H2127)
MFCD04050149
N(1((2CHLORO4FLUOROPHENYL)METHYL)35DIMETHYLPYRAZOL4YL)1ETHYL4NITROPYRAZOLE3CARBOXAMIDE
N(1(2chloro4fluorobenzyl)35dimethyl1Hpyrazol4yl)1ethyl4nitro1Hpyrazole3carboxamide
ZINC000002785476
ZINC02785476
ZINC2785476
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