Vitas-M small molecule compound
(5E)-5-[(5-bromo-1H-indol-3-yl)methylidene]-1-(3-chloro-2-methylphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK189457
SMILES Brc1ccc2c(c1)c(c[nH]2)/C=C/1\C(=O)NC(=S)N(C1=O)c1cccc(c1C)Cl
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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 C20H13BrClN3O2S MW 474.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13BrClN3O2S/c1-10-15(22)3-2-4-17(10)25-19(27)14(18(26)24-20(25)28)7-11-9-23-16-6-5-12(21)8-13(11)16/h2-9,23H,1H3,(H,24,26,28)/b14-7+InChIKey
ONKCJGWBOSTKME-VGOFMYFVSA-NSynonyms
(5E)5((5BROMO1HINDOL3YL)METHYLIDENE)1(3CHLORO2METHYLPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)5((5BROMO1HINDOL3YL)METHYLIDENE)1(3CHLORO2METHYLPHENYL)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
Brc1ccc2c(c1)c(c(nH)2)C=C1C(=O)NC(=S)N(C1=O)c1cccc(c1C)Cl
CC1=C(C=CC=C1Cl)N2C(=O)C(=CC3=CNC4=C3C=C(C=C4)Br)C(=O)NC2=S
InChI=1SC20H13BrClN3O2Sc11015(22)32417(10)2519(27)14(18(26)2420(25)28)711923166512(21)813(11)16h2923H1H3(H242628)b147+
MFCD03923144
ZINC000001135765
ZINC01135765
ZINC1135765
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