Vitas-M small molecule compound
(5E)-1-(3-chlorophenyl)-5-[(1-ethyl-1H-indol-3-yl)methylidene]-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STK595436
SMILES CCn1cc(c2c1cccc2)/C=C/1\C(=O)N=C(N(C1=O)c1cccc(c1)Cl)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 C21H16ClN3O2S MW 409.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16ClN3O2S/c1-2-24-12-13(16-8-3-4-9-18(16)24)10-17-19(26)23-21(28)25(20(17)27)15-7-5-6-14(22)11-15/h3-12H,2H2,1H3,(H,23,26,28)/b17-10+InChIKey
PBFBPNDVGVSFDV-LICLKQGHSA-NSynonyms
690685-89-3(5E)1(3chlorophenyl)5((1ethyl1Hindol3yl)methylidene)2sulfanylpyrimidine46(1H5H)dione
(5E)1(3CHLOROPHENYL)5((1ETHYLINDOL3YL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
690685893
CCN1C=C(C2=CC=CC=C21)C=C3C(=O)NC(=S)N(C3=O)C4=CC(=CC=C4)Cl
CCn1cc(c2c1cccc2)C=C1C(=O)N=C(N(C1=O)c1cccc(c1)Cl)S
InChI=1SC21H16ClN3O2Sc12241213(16834918(16)24)101719(26)2321(28)25(20(17)27)1575614(22)1115h312H2H21H3(H232628)b1710+
MFCD07201752
ZINC000009111311
ZINC9111311
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