Vitas-M small molecule compound
7'-{(E)-[1-(2-ethoxyphenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}-1,3-dimethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Catalog ID
STK572269
SMILES CCOc1ccccc1N1C(=O)N=C(/C(=C\c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O)O
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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 C30H29N5O7 MW 571.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N5O7/c1-4-42-22-9-6-5-8-21(22)35-25(37)19(24(36)31-28(35)40)15-17-11-12-20-18(14-17)16-30(23-10-7-13-34(20)23)26(38)32(2)29(41)33(3)27(30)39/h5-6,8-9,11-12,14-15,23H,4,7,10,13,16H2,1-3H3,(H,31,36,40)/b19-15+InChIKey
IDSLIDSIAHXGRD-XDJHFCHBSA-NSynonyms
892620-69-87((E)(1(2ethoxyphenyl)4hydroxy26dioxo16dihydropyrimidin5(2H)ylidene)methyl)13dimethyl1233atetrahydro2H5Hspiro(pyrimidine54pyrrolo(12a)quinoline)246(1H3H)trion
892620698
CCOc1ccccc1N1C(=O)N=C(C(=Cc2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)C1=O)O
MFCD07200559
ZINC000097967839
ZINC000097967840
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