Vitas-M small molecule compound
1-[4-(1H-benzimidazol-2-ylsulfanyl)-3-nitrophenyl]ethanone
Catalog ID
STK723638
SMILES [O-][N+](=O)c1cc(ccc1Sc1nc2c([nH]1)cccc2)C(=O)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 C15H11N3O3S MW 313.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H11N3O3S/c1-9(19)10-6-7-14(13(8-10)18(20)21)22-15-16-11-4-2-3-5-12(11)17-15/h2-8H,1H3,(H,16,17)InChIKey
SLPIJEOCCRQURC-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1cc(ccc1Sc1nc2c((nH)1)cccc2)C(=O)C
1(4(1Hbenzimidazol2ylsulfanyl)3nitrophenyl)ethanone
1ACETYL4BENZIMIDAZOL2YLTHIO3NITROBENZENE
CC(=O)C1=CC(=C(C=C1)SC2=NC3=CC=CC=C3N2)(N+)(=O)(O)
InChI=1SC15H11N3O3Sc19(19)106714(13(810)18(20)21)22151611423512(11)1715h28H1H3(H1617)
MFCD04067196
ZINC000001067344
ZINC01067344
ZINC1067344
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