Vitas-M small molecule compound
(5E)-5-{[1-(2-chlorobenzyl)-2,3-dihydro-1H-indol-5-yl]methylidene}-2-sulfanyl-1-[3-(trifluoromethyl)phenyl]pyrimidine-4,6(1H,5H)-dione
Catalog ID
STL056266
SMILES O=C1N=C(S)N(C(=O)/C/1=C/c1ccc2c(c1)CCN2Cc1ccccc1Cl)c1cccc(c1)C(F)(F)F
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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 C27H19ClF3N3O2S MW 541.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19ClF3N3O2S/c28-22-7-2-1-4-18(22)15-33-11-10-17-12-16(8-9-23(17)33)13-21-24(35)32-26(37)34(25(21)36)20-6-3-5-19(14-20)27(29,30)31/h1-9,12-14H,10-11,15H2,(H,32,35,37)/b21-13+InChIKey
ROJMVYFBZVQNJI-FYJGNVAPSA-NSynonyms
714234-77-2(5E)5((1((2CHLOROPHENYL)METHYL)23DIHYDROINDOL5YL)METHYLIDENE)2SULFANYLIDENE1(3(TRIFLUOROMETHYL)PHENYL)13DIAZINANE46DIONE
(5E)5((1(2chlorobenzyl)23dihydro1Hindol5yl)methylidene)2sulfanyl1(3(trifluoromethyl)phenyl)pyrimidine46(1H5H)dione
714234772
C1CN(C2=C1C=C(C=C2)C=C3C(=O)NC(=S)N(C3=O)C4=CC=CC(=C4)C(F)(F)F)CC5=CC=CC=C5Cl
InChI=1SC27H19ClF3N3O2Sc2822721418(22)15331110171216(8923(17)33)132124(35)3226(37)34(25(21)36)2063519(1420)27(2930)31h191214H101115H2(H323537)b2113+
MFCD05728823
O=C1N=C(S)N(C(=O)C1=Cc1ccc2c(c1)CCN2Cc1ccccc1Cl)c1cccc(c1)C(F)(F)F
ZINC000002403904
ZINC02403904
ZINC2403904
Check stock
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Check stock on Vitas-MAvailable files
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