Vitas-M small molecule compound
2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-[3,5-dimethyl-1-(4-methylbenzyl)-1H-pyrazol-4-yl]acetamide
Catalog ID
STL395065
SMILES Cc1ccc(cc1)Cn1nc(c(c1C)NC(=O)Cn1nc(c(c1C)Cl)[N+](=O)[O-])C
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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 C19H21ClN6O3 MW 416.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21ClN6O3/c1-11-5-7-15(8-6-11)9-24-14(4)18(12(2)22-24)21-16(27)10-25-13(3)17(20)19(23-25)26(28)29/h5-8H,9-10H2,1-4H3,(H,21,27)InChIKey
MLOBYOSRKRCYOB-UHFFFAOYSA-NSynonyms
489450-43-32(4CHLORO3NITRO5METHYL1HPYRAZOL1YL)N(35DIMETHYL1(4METHYLBENZYL)1HPYRAZOL4YL)ACETAMIDE
2(4CHLORO5METHYL3NITRO1HPYRAZOL1YL)N(35DIMETHYL1(4METHYLBENZYL)1HPYRAZOL4YL)ACETAMIDE
2(4CHLORO5METHYL3NITROPYRAZOL1YL)N(35DIMETHYL1((4METHYLPHENYL)METHYL)PYRAZOL4YL)ACETAMIDE
489450433
CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)NC(=O)CN3C(=C(C(=N3)(N+)(=O)(O))Cl)C)C
Cc1ccc(cc1)Cn1nc(c(c1C)NC(=O)Cn1nc(c(c1C)Cl)(N+)(=O)(O))C
InChI=1SC19H21ClN6O3c1115715(8611)92414(4)18(12(2)2224)2116(27)102513(3)17(20)19(2325)26(28)29h58H910H214H3(H2127)
MFCD02055685
ZINC000000647169
ZINC00647169
ZINC647169
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