Vitas-M small molecule compound
5-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]-1,3-dimethyl-6-nitro-1,3-dihydro-2H-benzimidazol-2-one
Catalog ID
STK172468
SMILES O=C(C(C)(C)C)N1CCN(CC1)c1cc2c(cc1[N+](=O)[O-])n(c(=O)n2C)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 C18H25N5O4 MW 375.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H25N5O4/c1-18(2,3)16(24)22-8-6-21(7-9-22)14-10-12-13(11-15(14)23(26)27)20(5)17(25)19(12)4/h10-11H,6-9H2,1-5H3InChIKey
OWBXPGOBZCHFBH-UHFFFAOYSA-NSynonyms
5(4(22DIMETHYLPROPANOYL)PIPERAZIN1YL)13DIMETHYL6NITRO13DIHYDRO2HBENZIMIDAZOL2ONE
5(4(22DIMETHYLPROPANOYL)PIPERAZIN1YL)13DIMETHYL6NITROBENZIMIDAZOL2ONE
6(4(22DIMETHYLPROPANOYL)PIPERAZINYL)13DIMETHYL5NITRO3HYDROBENZIMIDAZOL2ONE
CC(C)(C)C(=O)N1CCN(CC1)C2=C(C=C3C(=C2)N(C(=O)N3C)C)(N+)(=O)(O)
InChI=1SC18H25N5O4c118(23)16(24)228621(7922)14101213(1115(14)23(26)27)20(5)17(25)19(12)4h1011H69H215H3
MFCD04220703
O=C(C(C)(C)C)N1CCN(CC1)c1cc2c(cc1(N+)(=O)(O))n(c(=O)n2C)C
ZINC000004458512
ZINC04458512
ZINC4458512
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