Vitas-M small molecule compound
3-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]-N-(2-methyl-4-nitrophenyl)benzamide
Catalog ID
STK317072
SMILES O=C(c1cccc(c1)Cn1cc(c(n1)[N+](=O)[O-])Br)Nc1ccc(cc1C)[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 C18H14BrN5O5 MW 460.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14BrN5O5/c1-11-7-14(23(26)27)5-6-16(11)20-18(25)13-4-2-3-12(8-13)9-22-10-15(19)17(21-22)24(28)29/h2-8,10H,9H2,1H3,(H,20,25)InChIKey
LRPWOQCGBAOYNR-UHFFFAOYSA-NSynonyms
493032-16-93((4bromo3nitro1Hpyrazol1yl)methyl)N(2methyl4nitrophenyl)benzamide
3((4BROMO3NITRO1HPYRAZOL1YL)METHYL)N(4NITRO2METHYLPHENYL)BENZAMIDE
3((4BROMO3NITROPYRAZOL1YL)METHYL)N(2METHYL4NITROPHENYL)BENZAMIDE
493032169
CC1=C(C=CC(=C1)(N+)(=O)(O))NC(=O)C2=CC(=CC=C2)CN3C=C(C(=N3)(N+)(=O)(O))Br
InChI=1SC18H14BrN5O5c111714(23(26)27)5616(11)2018(25)1342312(813)9221015(19)17(2122)24(28)29h2810H9H21H3(H2025)
MFCD03071957
O=C(c1cccc(c1)Cn1cc(c(n1)(N+)(=O)(O))Br)Nc1ccc(cc1C)(N+)(=O)(O)
ZINC000008453634
ZINC08453634
ZINC8453634
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