Vitas-M small molecule compound
6-[4-(2,3-dimethylphenyl)piperazin-1-yl]-1,4-dimethyl-7-nitro-1,4-dihydroquinoxaline-2,3-dione
Catalog ID
STL431050
SMILES [O-][N+](=O)c1cc2c(cc1N1CCN(CC1)c1cccc(c1C)C)n(C)c(=O)c(=O)n2C
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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 C22H25N5O4 MW 423.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N5O4/c1-14-6-5-7-16(15(14)2)25-8-10-26(11-9-25)19-12-17-18(13-20(19)27(30)31)24(4)22(29)21(28)23(17)3/h5-7,12-13H,8-11H2,1-4H3InChIKey
CBXNCWGLQSHPFK-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1cc2c(cc1N1CCN(CC1)c1cccc(c1C)C)n(C)c(=O)c(=O)n2C
6(4(23dimethylphenyl)piperazin1yl)14dimethyl7nitro14dihydroquinoxaline23dione
6(4(23DIMETHYLPHENYL)PIPERAZIN1YL)14DIMETHYL7NITROQUINOXALINE23DIONE
CC1=C(C(=CC=C1)N2CCN(CC2)C3=C(C=C4C(=C3)N(C(=O)C(=O)N4C)C)(N+)(=O)(O))C
InChI=1SC22H25N5O4c11465716(15(14)2)2581026(11925)19121718(1320(19)27(30)31)24(4)22(29)21(28)23(17)3h571213H811H214H3
MFCD07360688
ZINC000004857044
ZINC04857044
ZINC4857044
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