Vitas-M small molecule compound
(5Z)-5-{[1-(3-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-(4-methoxyphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK192873
SMILES COc1ccc(cc1)N1C(=S)NC(=O)/C(=C/c2cc(n(c2C)c2cccc(c2)F)C)/C1=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 C24H20FN3O3S MW 449.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20FN3O3S/c1-14-11-16(15(2)27(14)19-6-4-5-17(25)13-19)12-21-22(29)26-24(32)28(23(21)30)18-7-9-20(31-3)10-8-18/h4-13H,1-3H3,(H,26,29,32)/b21-12-InChIKey
VXWCLHAHSSSGDM-MTJSOVHGSA-NSynonyms
(5Z)5((1(3FLUOROPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)1(4METHOXYPHENYL)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
(5Z)5((1(3FLUOROPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)1(4METHOXYPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
CC1=CC(=C(N1C2=CC(=CC=C2)F)C)C=C3C(=O)NC(=S)N(C3=O)C4=CC=C(C=C4)OC
COc1ccc(cc1)N1C(=S)NC(=O)C(=Cc2cc(n(c2C)c2cccc(c2)F)C)C1=O
InChI=1SC24H20FN3O3Sc1141116(15(2)27(14)1964517(25)1319)122122(29)2624(32)28(23(21)30)187920(313)10818h413H13H3(H262932)b2112
MFCD04480176
ZINC000000660737
ZINC00660737
ZINC660737
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