Vitas-M small molecule compound
(5Z)-5-{[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-[4-(propan-2-yl)phenyl]-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STL054196
SMILES Fc1ccc(cc1)n1c(C)cc(c1C)/C=C\1/C(=O)N=C(N(C1=O)c1ccc(cc1)C(C)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 C26H24FN3O2S MW 461.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24FN3O2S/c1-15(2)18-5-9-22(10-6-18)30-25(32)23(24(31)28-26(30)33)14-19-13-16(3)29(17(19)4)21-11-7-20(27)8-12-21/h5-15H,1-4H3,(H,28,31,33)/b23-14-InChIKey
QRDNCYKXXSPFRR-UCQKPKSFSA-NSynonyms
578750-94-4(5Z)5((1(4fluorophenyl)25dimethyl1Hpyrrol3yl)methylidene)1(4(propan2yl)phenyl)2sulfanylpyrimidine46(1H5H)dione
(5Z)5((1(4FLUOROPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)1(4PROPAN2YLPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
578750944
CC1=CC(=C(N1C2=CC=C(C=C2)F)C)C=C3C(=O)NC(=S)N(C3=O)C4=CC=C(C=C4)C(C)C
Fc1ccc(cc1)n1c(C)cc(c1C)C=C1C(=O)N=C(N(C1=O)c1ccc(cc1)C(C)C)S
InChI=1SC26H24FN3O2Sc115(2)185922(10618)3025(32)23(24(31)2826(30)33)14191316(3)29(17(19)4)2111720(27)81221h515H14H3(H283133)b2314
MFCD05727971
ZINC000009424573
ZINC9424573
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