Vitas-M small molecule compound
4-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-3-nitrobenzaldehyde
Catalog ID
STL296145
SMILES COc1ccc2c(c1)[nH]c(n2)Sc1ccc(cc1[N+](=O)[O-])C=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 C15H11N3O4S MW 329.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H11N3O4S/c1-22-10-3-4-11-12(7-10)17-15(16-11)23-14-5-2-9(8-19)6-13(14)18(20)21/h2-8H,1H3,(H,16,17)InChIKey
XUPOCCUKUOWZCR-UHFFFAOYSA-NSynonyms
4((6methoxy1Hbenzimidazol2yl)sulfanyl)3nitrobenzaldehyde
COC1=CC2=C(C=C1)N=C(N2)SC3=C(C=C(C=C3)C=O)(N+)(=O)(O)
COc1ccc2c(c1)(nH)c(n2)Sc1ccc(cc1(N+)(=O)(O))C=O
InChI=1SC15H11N3O4Sc12210341112(710)1715(1611)2314529(819)613(14)18(20)21h28H1H3(H1617)
MFCD08067848
ZINC000009187524
ZINC09187524
ZINC9187524
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