Vitas-M small molecule compound
1,3-dimethyl-5-{4-[(4-methylphenyl)carbonyl]piperazin-1-yl}-6-nitro-1,3-dihydro-2H-benzimidazol-2-one
Catalog ID
STK172449
SMILES Cc1ccc(cc1)C(=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 C21H23N5O4 MW 409.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5O4/c1-14-4-6-15(7-5-14)20(27)25-10-8-24(9-11-25)18-12-16-17(13-19(18)26(29)30)23(3)21(28)22(16)2/h4-7,12-13H,8-11H2,1-3H3InChIKey
VCTCQDJWOIOJCR-UHFFFAOYSA-NSynonyms
13DIMETHYL5(4((4METHYLPHENYL)CARBONYL)PIPERAZIN1YL)6NITRO13DIHYDRO2HBENZIMIDAZOL2ONE
13DIMETHYL5(4((4METHYLPHENYL)CARBONYL)PIPERAZINYL)6NITRO3HYDROBENZIMIDAZOL2ONE
13DIMETHYL5(4(4METHYLBENZOYL)PIPERAZIN1YL)6NITRO13DIHYDROBENZOIMIDAZOL2ONE
13DIMETHYL5(4(4METHYLBENZOYL)PIPERAZIN1YL)6NITROBENZIMIDAZOL2ONE
CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C4C(=C3)N(C(=O)N4C)C)(N+)(=O)(O)
Cc1ccc(cc1)C(=O)N1CCN(CC1)c1cc2n(C)c(=O)n(c2cc1(N+)(=O)(O))C
InChI=1SC21H23N5O4c1144615(7514)20(27)2510824(91125)18121617(1319(18)26(29)30)23(3)21(28)22(16)2h471213H811H213H3
MFCD05134226
ZINC000004458511
ZINC04458511
ZINC4458511
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