Vitas-M small molecule compound
(5E)-5-[(1-butyl-2,3-dihydro-1H-indol-5-yl)methylidene]-2-sulfanyl-1-[3-(trifluoromethyl)phenyl]pyrimidine-4,6(1H,5H)-dione
Catalog ID
STL051285
SMILES CCCCN1CCc2c1ccc(c2)/C=C/1\C(=O)N=C(N(C1=O)c1cccc(c1)C(F)(F)F)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 C24H22F3N3O2S MW 473.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22F3N3O2S/c1-2-3-10-29-11-9-16-12-15(7-8-20(16)29)13-19-21(31)28-23(33)30(22(19)32)18-6-4-5-17(14-18)24(25,26)27/h4-8,12-14H,2-3,9-11H2,1H3,(H,28,31,33)/b19-13+InChIKey
BJYCFSKGIMFKAZ-CPNJWEJPSA-NSynonyms
587006-23-3(5E)5((1butyl23dihydro1Hindol5yl)methylidene)2sulfanyl1(3(trifluoromethyl)phenyl)pyrimidine46(1H5H)dione
(5E)5((1BUTYL23DIHYDROINDOL5YL)METHYLIDENE)2SULFANYLIDENE1(3(TRIFLUOROMETHYL)PHENYL)13DIAZINANE46DIONE
587006233
CCCCN1CCC2=C1C=CC(=C2)C=C3C(=O)NC(=S)N(C3=O)C4=CC=CC(=C4)C(F)(F)F
CCCCN1CCc2c1ccc(c2)C=C1C(=O)N=C(N(C1=O)c1cccc(c1)C(F)(F)F)S
InChI=1SC24H22F3N3O2Sc1231029119161215(7820(16)29)131921(31)2823(33)30(22(19)32)1864517(1418)24(2526)27h481214H23911H21H3(H283133)b1913+
MFCD05732091
ZINC000017248076
ZINC17248076
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