Vitas-M small molecule compound
(5E)-5-{[1-(3-chloropropyl)-2,3-dihydro-1H-indol-5-yl]methylidene}-2-sulfanyl-1-[3-(trifluoromethyl)phenyl]pyrimidine-4,6(1H,5H)-dione
Catalog ID
STL055831
SMILES ClCCCN1CCc2c1ccc(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 C23H19ClF3N3O2S MW 493.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19ClF3N3O2S/c24-8-2-9-29-10-7-15-11-14(5-6-19(15)29)12-18-20(31)28-22(33)30(21(18)32)17-4-1-3-16(13-17)23(25,26)27/h1,3-6,11-13H,2,7-10H2,(H,28,31,33)/b18-12+InChIKey
QOMJMMXLLKTBER-LDADJPATSA-NSynonyms
714935-69-0(5E)5((1(3chloropropyl)23dihydro1Hindol5yl)methylidene)2sulfanyl1(3(trifluoromethyl)phenyl)pyrimidine46(1H5H)dione
(5E)5((1(3CHLOROPROPYL)23DIHYDROINDOL5YL)METHYLIDENE)2SULFANYLIDENE1(3(TRIFLUOROMETHYL)PHENYL)13DIAZINANE46DIONE
714935690
C1CN(C2=C1C=C(C=C2)C=C3C(=O)NC(=S)N(C3=O)C4=CC=CC(=C4)C(F)(F)F)CCCCl
ClCCCN1CCc2c1ccc(c2)C=C1C(=O)N=C(N(C1=O)c1cccc(c1)C(F)(F)F)S
InChI=1SC23H19ClF3N3O2Sc2482929107151114(5619(15)29)121820(31)2822(33)30(21(18)32)1741316(1317)23(2526)27h1361113H2710H2(H283133)b1812+
MFCD05735409
ZINC000002409431
ZINC2409431
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