Vitas-M small molecule compound
(5Z)-5-{[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-(4-methylphenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STL048867
SMILES Cc1ccc(cc1)N1C(=NC(=O)/C(=C/c2cc(n(c2C)c2ccc(cc2)F)C)/C1=O)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 C24H20FN3O2S MW 433.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20FN3O2S/c1-14-4-8-20(9-5-14)28-23(30)21(22(29)26-24(28)31)13-17-12-15(2)27(16(17)3)19-10-6-18(25)7-11-19/h4-13H,1-3H3,(H,26,29,31)/b21-13-InChIKey
PXKFXSILOJRNSH-BKUYFWCQSA-NSynonyms
575463-65-9(5Z)5((1(4fluorophenyl)25dimethyl1Hpyrrol3yl)methylidene)1(4methylphenyl)2sulfanylpyrimidine46(1H5H)dione
(5Z)5((1(4FLUOROPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)1(4METHYLPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
575463659
CC1=CC=C(C=C1)N2C(=O)C(=CC3=C(N(C(=C3)C)C4=CC=C(C=C4)F)C)C(=O)NC2=S
Cc1ccc(cc1)N1C(=NC(=O)C(=Cc2cc(n(c2C)c2ccc(cc2)F)C)C1=O)S
InChI=1SC24H20FN3O2Sc1144820(9514)2823(30)21(22(29)2624(28)31)13171215(2)27(16(17)3)1910618(25)71119h413H13H3(H262931)b2113
MFCD05733955
ZINC000009425299
ZINC09425299
ZINC9425299
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