Vitas-M small molecule compound
7'-{(E)-[1-(3,5-dimethylphenyl)-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
STK588809
SMILES Cc1cc(C)cc(c1)N1C(=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 C30H29N5O6 MW 555.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N5O6/c1-16-10-17(2)12-20(11-16)35-25(37)21(24(36)31-28(35)40)14-18-7-8-22-19(13-18)15-30(23-6-5-9-34(22)23)26(38)32(3)29(41)33(4)27(30)39/h7-8,10-14,23H,5-6,9,15H2,1-4H3,(H,31,36,40)/b21-14+InChIKey
OTFZEVXYQQWDNP-KGENOOAVSA-NSynonyms
892617-63-97((E)(1(35dimethylphenyl)4hydroxy26dioxo16dihydropyrimidin5(2H)ylidene)methyl)13dimethyl1233atetrahydro2H5Hspiro(pyrimidine54pyrrolo(12a)quinoline)246(1H3H)t
892617639
Cc1cc(C)cc(c1)N1C(=O)N=C(C(=Cc2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)C1=O)O
MFCD07199969
ZINC000097968166
ZINC000097968167
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