Vitas-M small molecule compound
1-[2-({[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl}sulfanyl)-1H-benzimidazol-1-yl]ethanone
Catalog ID
STK124569
SMILES [O-][N+](=O)c1ccc(cc1)c1nnc(o1)CSc1nc2c(n1C(=O)C)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 C18H13N5O4S MW 395.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13N5O4S/c1-11(24)22-15-5-3-2-4-14(15)19-18(22)28-10-16-20-21-17(27-16)12-6-8-13(9-7-12)23(25)26/h2-9H,10H2,1H3InChIKey
MBXGFAQOVNYDHF-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc(cc1)c1nnc(o1)CSc1nc2c(n1C(=O)C)cccc2
1(2(((5(4NITROPHENYL)134OXADIAZOL2YL)METHYL)SULFANYL)1HBENZIMIDAZOL1YL)ETHANONE
1(2((5(4NITROPHENYL)134OXADIAZOL2YL)METHYLSULFANYL)BENZIMIDAZOL1YL)ETHANONE
CC(=O)N1C2=CC=CC=C2N=C1SCC3=NN=C(O3)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC18H13N5O4Sc111(24)2215532414(15)1918(22)281016202117(2716)126813(9712)23(25)26h29H10H21H3
MFCD01808258
ZINC000002798115
ZINC02798115
ZINC2798115
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