Vitas-M small molecule compound
2-[(1-benzyl-5,6-difluoro-1H-benzimidazol-2-yl)sulfanyl]-1-(4-nitrophenyl)ethanone
Catalog ID
STK701066
SMILES O=C(c1ccc(cc1)[N+](=O)[O-])CSc1nc2c(n1Cc1ccccc1)cc(c(c2)F)F
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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 C22H15F2N3O3S MW 439.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15F2N3O3S/c23-17-10-19-20(11-18(17)24)26(12-14-4-2-1-3-5-14)22(25-19)31-13-21(28)15-6-8-16(9-7-15)27(29)30/h1-11H,12-13H2InChIKey
IYAVXNCDZLGTDT-UHFFFAOYSA-NSynonyms
2((1benzyl56difluoro1Hbenzimidazol2yl)sulfanyl)1(4nitrophenyl)ethanone
2((1benzyl56difluoro1Hbenzo(d)imidazol2yl)thio)1(4nitrophenyl)ethanone
2(1BENZYL56DIFLUOROBENZIMIDAZOL2YL)SULFANYL1(4NITROPHENYL)ETHANONE
C1=CC=C(C=C1)CN2C3=CC(=C(C=C3N=C2SCC(=O)C4=CC=C(C=C4)(N+)(=O)(O))F)F
InChI=1SC22H15F2N3O3Sc2317101920(1118(17)24)26(12144213514)22(2519)311321(28)156816(9715)27(29)30h111H1213H2
MFCD02140249
O=C(c1ccc(cc1)(N+)(=O)(O))CSc1nc2c(n1Cc1ccccc1)cc(c(c2)F)F
ZINC000009008970
ZINC09008970
ZINC9008970
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