Vitas-M small molecule compound
5-{4-[(4-fluorophenyl)sulfonyl]piperazin-1-yl}-1,3-dimethyl-6-nitro-1,3-dihydro-2H-benzimidazol-2-one
Catalog ID
STK206085
SMILES Fc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1cc2n(C)c(=O)n(c2cc1[N+](=O)[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 C19H20FN5O5S MW 449.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20FN5O5S/c1-21-15-11-17(18(25(27)28)12-16(15)22(2)19(21)26)23-7-9-24(10-8-23)31(29,30)14-5-3-13(20)4-6-14/h3-6,11-12H,7-10H2,1-2H3InChIKey
ABONENNWNGIRLT-UHFFFAOYSA-NSynonyms
5(4((4FLUOROPHENYL)SULFONYL)PIPERAZIN1YL)13DIMETHYL6NITRO13DIHYDRO2HBENZIMIDAZOL2ONE
5(4(4fluorophenyl)sulfonylpiperazin1yl)13dimethyl6nitrobenzimidazol2one
CN1C2=CC(=C(C=C2N(C1=O)C)(N+)(=O)(O))N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)F
Fc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1cc2n(C)c(=O)n(c2cc1(N+)(=O)(O))C
InChI=1SC19H20FN5O5Sc121151117(18(25(27)28)1216(15)22(2)19(21)26)237924(10823)31(2930)145313(20)4614h361112H710H212H3
MFCD06666789
ZINC000009971885
ZINC09971885
ZINC9971885
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