Vitas-M small molecule compound
(5E)-1-(4-chlorophenyl)-5-[(1-ethyl-1H-indol-3-yl)methylidene]-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STL048605
SMILES CCn1cc(c2c1cccc2)/C=C/1\C(=O)N=C(N(C1=O)c1ccc(cc1)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(16-5-3-4-6-18(16)24)11-17-19(26)23-21(28)25(20(17)27)15-9-7-14(22)8-10-15/h3-12H,2H2,1H3,(H,23,26,28)/b17-11+InChIKey
UNYIUZKYGNLHBW-GZTJUZNOSA-NSynonyms
578000-08-5(5E)1(4chlorophenyl)5((1ethyl1Hindol3yl)methylidene)2sulfanylpyrimidine46(1H5H)dione
(5E)1(4CHLOROPHENYL)5((1ETHYLINDOL3YL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
578000085
CCN1C=C(C2=CC=CC=C21)C=C3C(=O)NC(=S)N(C3=O)C4=CC=C(C=C4)Cl
CCn1cc(c2c1cccc2)C=C1C(=O)N=C(N(C1=O)c1ccc(cc1)Cl)S
InChI=1SC21H16ClN3O2Sc12241213(16534618(16)24)111719(26)2321(28)25(20(17)27)159714(22)81015h312H2H21H3(H232628)b1711+
MFCD05727463
ZINC000002368946
ZINC2368946
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