Vitas-M small molecule compound
3-({(E)-[17-(4-methylphenyl)-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-1-yl]methylidene}amino)benzoic acid (non-preferred name)
Catalog ID
STK670791
SMILES Cc1ccc(cc1)N1C(=O)C2C(C1=O)C1(/C=N/c3cccc(c3)C(=O)O)c3c(C2c2c1cccc2)cccc3
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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 C33H24N2O4 MW 512.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H24N2O4/c1-19-13-15-22(16-14-19)35-30(36)28-27-23-9-2-4-11-25(23)33(29(28)31(35)37,26-12-5-3-10-24(26)27)18-34-21-8-6-7-20(17-21)32(38)39/h2-18,27-29H,1H3,(H,38,39)/b34-18+InChIKey
FFBCTMOFWIQYFC-FABQOPTDSA-NSynonyms
3(((E)(17(4methylphenyl)1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaen1yl)methylidene)amino)benzoicacid(nonpreferredname)
Cc1ccc(cc1)N1C(=O)C2C(C1=O)C1(C=Nc3cccc(c3)C(=O)O)c3c(C2c2c1cccc2)cccc3
MFCD00739934
ZINC000001434053
ZINC000015133843
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