Vitas-M small molecule compound
2-[(2-chloro-5-nitrobenzyl)sulfanyl]-4,7-dimethoxy-1H-benzimidazole
Catalog ID
STK665787
SMILES COc1ccc(c2c1[nH]c(n2)SCc1cc(ccc1Cl)[N+](=O)[O-])OC
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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 C16H14ClN3O4S MW 379.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14ClN3O4S/c1-23-12-5-6-13(24-2)15-14(12)18-16(19-15)25-8-9-7-10(20(21)22)3-4-11(9)17/h3-7H,8H2,1-2H3,(H,18,19)InChIKey
BQSVTCQEGCVWFW-UHFFFAOYSA-NSynonyms
2((2chloro5nitrobenzyl)sulfanyl)47dimethoxy1Hbenzimidazole
2((2chloro5nitrophenyl)methylsulfanyl)47dimethoxy1Hbenzimidazole
COC1=C2C(=C(C=C1)OC)N=C(N2)SCC3=C(C=CC(=C3)(N+)(=O)(O))Cl
COc1ccc(c2c1(nH)c(n2)SCc1cc(ccc1Cl)(N+)(=O)(O))OC
InChI=1SC16H14ClN3O4Sc123125613(242)1514(12)1816(1915)2589710(20(21)22)3411(9)17h37H8H212H3(H1819)
MFCD12033953
ZINC000015108569
ZINC15108569
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