Vitas-M small molecule compound
methyl 3-{[(4-ethoxy-3-nitrophenyl)carbonyl]amino}-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate
Catalog ID
STK219922
SMILES CCOc1ccc(cc1[N+](=O)[O-])C(=O)Nc1cc(ccc1N1CCN(CC1)C(=O)c1ccccc1)C(=O)OC
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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 C28H28N4O7 MW 532.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N4O7/c1-3-39-25-12-10-20(18-24(25)32(36)37)26(33)29-22-17-21(28(35)38-2)9-11-23(22)30-13-15-31(16-14-30)27(34)19-7-5-4-6-8-19/h4-12,17-18H,3,13-16H2,1-2H3,(H,29,33)InChIKey
WXNNBUQKUOEIMN-UHFFFAOYSA-NSynonyms
CCOC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)OC)N3CCN(CC3)C(=O)C4=CC=CC=C4)(N+)(=O)(O)
CCOc1ccc(cc1(N+)(=O)(O))C(=O)Nc1cc(ccc1N1CCN(CC1)C(=O)c1ccccc1)C(=O)OC
InChI=1SC28H28N4O7c133925121020(1824(25)32(36)37)26(33)29221721(28(35)382)91123(22)30131531(161430)27(34)197546819h4121718H31316H212H3(H2933)
METHYL3(((4ETHOXY3NITROPHENYL)CARBONYL)AMINO)4(4(PHENYLCARBONYL)PIPERAZIN1YL)BENZOATE
methyl4(4benzoylpiperazin1yl)3((4ethoxy3nitrobenzoyl)amino)benzoate
MFCD06665411
ZINC000097945612
ZINC97945612
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