Vitas-M small molecule compound
4-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-N-[1-(3-fluorobenzyl)-1H-pyrazol-4-yl]benzamide
Catalog ID
STL398681
SMILES Fc1cccc(c1)Cn1ncc(c1)NC(=O)c1ccc(cc1)Cn1cc(c(n1)[N+](=O)[O-])Cl
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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 C21H16ClFN6O3 MW 454.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16ClFN6O3/c22-19-13-28(26-20(19)29(31)32)10-14-4-6-16(7-5-14)21(30)25-18-9-24-27(12-18)11-15-2-1-3-17(23)8-15/h1-9,12-13H,10-11H2,(H,25,30)InChIKey
SCRIYTNBSWLUMS-UHFFFAOYSA-NSynonyms
1005621-64-61005621646
4((4CHLORO3NITRO1HPYRAZOL1YL)METHYL)N(1(3FLUOROBENZYL)1HPYRAZOL4YL)BENZAMIDE
4((4chloro3nitropyrazol1yl)methyl)N(1((3fluorophenyl)methyl)pyrazol4yl)benzamide
C1=CC(=CC(=C1)F)CN2C=C(C=N2)NC(=O)C3=CC=C(C=C3)CN4C=C(C(=N4)(N+)(=O)(O))Cl
Fc1cccc(c1)Cn1ncc(c1)NC(=O)c1ccc(cc1)Cn1cc(c(n1)(N+)(=O)(O))Cl
InChI=1SC21H16ClFN6O3c22191328(2620(19)29(31)32)10144616(7514)21(30)251892427(1218)111521317(23)815h191213H1011H2(H2530)
MFCD04138059
ZINC000002809543
ZINC02809543
ZINC2809543
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