Vitas-M small molecule compound

2-[(4-nitrobenzyl)sulfanyl]-1H-benzimidazole

Catalog ID
STK720082
SMILES [O-][N+](=O)c1ccc(cc1)CSc1nc2c([nH]1)cccc2

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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 C14H11N3O2S MW 285.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11N3O2S/c18-17(19)11-7-5-10(6-8-11)9-20-14-15-12-3-1-2-4-13(12)16-14/h1-8H,9H2,(H,15,16)
InChIKey
GQKNIBASRJXHPJ-UHFFFAOYSA-N
Synonyms
100541-50-2
(O)(N+)(=O)c1ccc(cc1)CSc1nc2c((nH)1)cccc2
100541502
1HBENZIMIDAZOLE2(((4NITROPHENYL)METHYL)THIO)
2(((4NITROPHENYL)METHYL)SULFANYL)1H13BENZODIAZOLE
2((4nitrobenzyl)sulfanyl)1Hbenzimidazole
2((4NITROBENZYL)THIO)1HBENZIMIDAZOLE
2((4nitrobenzyl)thio)1Hbenzo(d)imidazole
2((4NITROPHENYL)METHYLSULFANYL)1HBENZIMIDAZOLE
2((4NITROPHENYL)METHYLTHIO)BENZIMIDAZOLE
2(4NITROBENZYLSULFANYL)1HBENZOIMIDAZOLE
2(4NITROBENZYLTHIO)1HBENZOIMIDAZOLE
C1=CC=C2C(=C1)NC(=N2)SCC3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC14H11N3O2Sc1817(19)117510(6811)920141512312413(12)1614h18H9H2(H1516)
MFCD00422158
ZINC000000058783
ZINC00058783
ZINC58783

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.