Vitas-M small molecule compound
(5E)-5-{[1-(2-chlorobenzyl)-2,3-dihydro-1H-indol-5-yl]methylidene}-1-(2-fluorophenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STL052107
SMILES O=C1N=C(S)N(C(=O)/C/1=C/c1ccc2c(c1)CCN2Cc1ccccc1Cl)c1ccccc1F
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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 C26H19ClFN3O2S MW 491.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19ClFN3O2S/c27-20-6-2-1-5-18(20)15-30-12-11-17-13-16(9-10-22(17)30)14-19-24(32)29-26(34)31(25(19)33)23-8-4-3-7-21(23)28/h1-10,13-14H,11-12,15H2,(H,29,32,34)/b19-14+InChIKey
POJMBMGRLMTBDI-XMHGGMMESA-NSynonyms
575462-82-7(5E)5((1((2CHLOROPHENYL)METHYL)23DIHYDROINDOL5YL)METHYLIDENE)1(2FLUOROPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)5((1(2chlorobenzyl)23dihydro1Hindol5yl)methylidene)1(2fluorophenyl)2sulfanylpyrimidine46(1H5H)dione
575462827
C1CN(C2=C1C=C(C=C2)C=C3C(=O)NC(=S)N(C3=O)C4=CC=CC=C4F)CC5=CC=CC=C5Cl
InChI=1SC26H19ClFN3O2Sc2720621518(20)15301211171316(91022(17)30)141924(32)2926(34)31(25(19)33)23843721(23)28h1101314H111215H2(H293234)b1914+
MFCD05730754
O=C1N=C(S)N(C(=O)C1=Cc1ccc2c(c1)CCN2Cc1ccccc1Cl)c1ccccc1F
ZINC000002377741
ZINC2377741
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