Vitas-M small molecule compound
(5E)-5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-1-(2,3-dimethylphenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STK560736
SMILES Cc1ccc(cc1)n1c(C)cc(c1C)/C=C/1\C(=O)N=C(N(C1=O)c1cccc(c1C)C)S
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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 C26H25N3O2S MW 443.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O2S/c1-15-9-11-21(12-10-15)28-17(3)13-20(19(28)5)14-22-24(30)27-26(32)29(25(22)31)23-8-6-7-16(2)18(23)4/h6-14H,1-5H3,(H,27,30,32)/b22-14+InChIKey
CBBXFCDUBIEKES-HYARGMPZSA-NSynonyms
(5E)5((25dimethyl1(4methylphenyl)1Hpyrrol3yl)methylidene)1(23dimethylphenyl)2sulfanylpyrimidine46(1H5H)dione
(5E)5((25DIMETHYL1(4METHYLPHENYL)PYRROL3YL)METHYLIDENE)1(23DIMETHYLPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
5((25DIMETHYL1(4METHYLPHENYL)1HPYRROL3YL)METHYLENE)1(23DIMETHYLPHENYL)2THIOXODIHYDRO46(1H5H)PYRIMIDINEDIONE
Cc1ccc(cc1)n1c(C)cc(c1C)C=C1C(=O)N=C(N(C1=O)c1cccc(c1C)C)S
InChI=1SC26H25N3O2Sc11591121(121015)2817(3)1320(19(28)5)142224(30)2726(32)29(25(22)31)2386716(2)18(23)4h614H15H3(H273032)b2214+
MFCD03793943
ZINC000017299690
ZINC17299690
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