Vitas-M small molecule compound
1,3-bis(4-methylbenzyl)-5,6-dinitro-1,3-dihydro-2H-benzimidazol-2-one
Catalog ID
STK728070
SMILES Cc1ccc(cc1)Cn1c(=O)n(c2c1cc([N+](=O)[O-])c(c2)[N+](=O)[O-])Cc1ccc(cc1)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 C23H20N4O5 MW 432.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N4O5/c1-15-3-7-17(8-4-15)13-24-19-11-21(26(29)30)22(27(31)32)12-20(19)25(23(24)28)14-18-9-5-16(2)6-10-18/h3-12H,13-14H2,1-2H3InChIKey
LMXDLOHAAXKQER-UHFFFAOYSA-NSynonyms
13BIS((4METHYLPHENYL)METHYL)56DINITROBENZIMIDAZOL2ONE
13bis(4methylbenzyl)56dinitro13dihydro2Hbenzimidazol2one
13BIS(4METHYLBENZYL)56DINITRO13DIHYDROBENZOIMIDAZOL2ONE
CC1=CC=C(C=C1)CN2C3=CC(=C(C=C3N(C2=O)CC4=CC=C(C=C4)C)(N+)(=O)(O))(N+)(=O)(O)
Cc1ccc(cc1)Cn1c(=O)n(c2c1cc((N+)(=O)(O))c(c2)(N+)(=O)(O))Cc1ccc(cc1)C
InChI=1SC23H20N4O5c1153717(8415)1324191121(26(29)30)22(27(31)32)1220(19)25(23(24)28)14189516(2)61018h312H1314H212H3
MFCD01035964
ZINC000008853451
ZINC08853451
ZINC8853451
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