Vitas-M small molecule compound
2-(benzylsulfonyl)-1-(4-methoxy-3-nitrobenzyl)-1H-benzimidazole
Catalog ID
STK775906
SMILES COc1ccc(cc1[N+](=O)[O-])Cn1c2ccccc2nc1S(=O)(=O)Cc1ccccc1
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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 C22H19N3O5S MW 437.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O5S/c1-30-21-12-11-17(13-20(21)25(26)27)14-24-19-10-6-5-9-18(19)23-22(24)31(28,29)15-16-7-3-2-4-8-16/h2-13H,14-15H2,1H3InChIKey
NHDBCPUTIJYPOS-UHFFFAOYSA-NSynonyms
2(benzylsulfonyl)1(4methoxy3nitrobenzyl)1Hbenzimidazole
2BENZYLSULFONYL1((4METHOXY3NITROPHENYL)METHYL)BENZIMIDAZOLE
COC1=C(C=C(C=C1)CN2C3=CC=CC=C3N=C2S(=O)(=O)CC4=CC=CC=C4)(N+)(=O)(O)
COc1ccc(cc1(N+)(=O)(O))Cn1c2ccccc2nc1S(=O)(=O)Cc1ccccc1
InChI=1SC22H19N3O5Sc13021121117(1320(21)25(26)27)1424191065918(19)2322(24)31(2829)15167324816h213H1415H21H3
MFCD05258031
ZINC000001078524
ZINC01078524
ZINC1078524
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