Vitas-M small molecule compound
methyl 4-(4-acetylpiperazin-1-yl)-3-{[(3-methyl-4-nitrophenyl)carbonyl]amino}benzoate
Catalog ID
STK179982
SMILES COC(=O)c1ccc(c(c1)NC(=O)c1ccc(c(c1)C)[N+](=O)[O-])N1CCN(CC1)C(=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 C22H24N4O6 MW 440.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N4O6/c1-14-12-16(4-6-19(14)26(30)31)21(28)23-18-13-17(22(29)32-3)5-7-20(18)25-10-8-24(9-11-25)15(2)27/h4-7,12-13H,8-11H2,1-3H3,(H,23,28)InChIKey
LEFSZJFBALUXDE-UHFFFAOYSA-NSynonyms
CC1=C(C=CC(=C1)C(=O)NC2=C(C=CC(=C2)C(=O)OC)N3CCN(CC3)C(=O)C)(N+)(=O)(O)
COC(=O)c1ccc(c(c1)NC(=O)c1ccc(c(c1)C)(N+)(=O)(O))N1CCN(CC1)C(=O)C
InChI=1SC22H24N4O6c1141216(4619(14)26(30)31)21(28)23181317(22(29)323)5720(18)2510824(91125)15(2)27h471213H811H213H3(H2328)
METHYL4(4ACETYLPIPERAZIN1YL)3(((3METHYL4NITROPHENYL)CARBONYL)AMINO)BENZOATE
methyl4(4acetylpiperazin1yl)3((3methyl4nitrobenzoyl)amino)benzoate
MFCD06664222
ZINC000009892715
ZINC09892715
ZINC9892715
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