Vitas-M small molecule compound
(5Z)-1-(2,3-dichlorophenyl)-5-{[1-(4-fluorophenyl)-1H-pyrrol-2-yl]methylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK196859
SMILES Fc1ccc(cc1)n1cccc1/C=C\1/C(=O)NC(=S)N(C1=O)c1cccc(c1Cl)Cl
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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 C21H12Cl2FN3O2S MW 460.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H12Cl2FN3O2S/c22-16-4-1-5-17(18(16)23)27-20(29)15(19(28)25-21(27)30)11-14-3-2-10-26(14)13-8-6-12(24)7-9-13/h1-11H,(H,25,28,30)/b15-11-InChIKey
FIZIVFDZYUXVGF-PTNGSMBKSA-NSynonyms
(5Z)1(23DICHLOROPHENYL)5((1(4FLUOROPHENYL)1HPYRROL2YL)METHYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
(5Z)1(23DICHLOROPHENYL)5((1(4FLUOROPHENYL)PYRROL2YL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
C1=CC(=C(C(=C1)Cl)Cl)N2C(=O)C(=CC3=CC=CN3C4=CC=C(C=C4)F)C(=O)NC2=S
Fc1ccc(cc1)n1cccc1C=C1C(=O)NC(=S)N(C1=O)c1cccc(c1Cl)Cl
InChI=1SC21H12Cl2FN3O2Sc221641517(18(16)23)2720(29)15(19(28)2521(27)30)1114321026(14)138612(24)7913h111H(H252830)b1511
MFCD03228206
ZINC000009311619
ZINC09311619
ZINC9311619
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