Vitas-M small molecule compound
3-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]-N-(2,3-dihydro-1H-inden-5-yl)benzamide
Catalog ID
STK316725
SMILES O=C(c1cccc(c1)Cn1cc(c(n1)[N+](=O)[O-])Br)Nc1ccc2c(c1)CCC2
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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 C20H17BrN4O3 MW 441.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17BrN4O3/c21-18-12-24(23-19(18)25(27)28)11-13-3-1-6-16(9-13)20(26)22-17-8-7-14-4-2-5-15(14)10-17/h1,3,6-10,12H,2,4-5,11H2,(H,22,26)InChIKey
BERRCEPVWHTROW-UHFFFAOYSA-NSynonyms
492423-28-63((4bromo3nitro1Hpyrazol1yl)methyl)N(23dihydro1Hinden5yl)benzamide
3((4BROMO3NITROPYRAZOL1YL)METHYL)N(23DIHYDRO1HINDEN5YL)BENZAMIDE
492423286
C1CC2=C(C1)C=C(C=C2)NC(=O)C3=CC(=CC=C3)CN4C=C(C(=N4)(N+)(=O)(O))Br
InChI=1SC20H17BrN4O3c21181224(2319(18)25(27)28)111331616(913)20(26)2217871442515(14)1017h1361012H24511H2(H2226)
MFCD03072896
O=C(c1cccc(c1)Cn1cc(c(n1)(N+)(=O)(O))Br)Nc1ccc2c(c1)CCC2
ZINC000002763086
ZINC02763086
ZINC2763086
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