Vitas-M small molecule compound
N-{1-[(4-bromophenoxy)methyl]-1H-pyrazol-4-yl}-3-(4-chloro-3-nitro-1H-pyrazol-1-yl)propanamide
Catalog ID
STL399590
SMILES O=C(Nc1cnn(c1)COc1ccc(cc1)Br)CCn1cc(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 C16H14BrClN6O4 MW 469.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14BrClN6O4/c17-11-1-3-13(4-2-11)28-10-23-8-12(7-19-23)20-15(25)5-6-22-9-14(18)16(21-22)24(26)27/h1-4,7-9H,5-6,10H2,(H,20,25)InChIKey
BEPPTLFXCQMAPV-UHFFFAOYSA-NSynonyms
1005671-05-51005671055
C1=CC(=CC=C1OCN2C=C(C=N2)NC(=O)CCN3C=C(C(=N3)(N+)(=O)(O))Cl)Br
InChI=1SC16H14BrClN6O4c17111313(4211)281023812(71923)2015(25)5622914(18)16(2122)24(26)27h1479H5610H2(H2025)
MFCD04140901
N(1((4BROMOPHENOXY)METHYL)1HPYRAZOL4YL)3(4CHLORO3NITRO1HPYRAZOL1YL)PROPANAMIDE
N(1((4bromophenoxy)methyl)pyrazol4yl)3(4chloro3nitropyrazol1yl)propanamide
O=C(Nc1cnn(c1)COc1ccc(cc1)Br)CCn1cc(c(n1)(N+)(=O)(O))Cl
ZINC000002732270
ZINC02732270
ZINC2732270
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