Vitas-M small molecule compound

(5Z)-1-(4-methoxyphenyl)-5-[(1-methyl-1H-indol-3-yl)methylidene]-2-sulfanylpyrimidine-4,6(1H,5H)-dione

Catalog ID
STL045072
SMILES COc1ccc(cc1)N1C(=NC(=O)/C(=C/c2cn(c3c2cccc3)C)/C1=O)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 C21H17N3O3S MW 391.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N3O3S/c1-23-12-13(16-5-3-4-6-18(16)23)11-17-19(25)22-21(28)24(20(17)26)14-7-9-15(27-2)10-8-14/h3-12H,1-2H3,(H,22,25,28)/b17-11-
InChIKey
DFQFHCADUQTFJB-BOPFTXTBSA-N
Synonyms
312915-41-6
(5Z)1(4methoxyphenyl)5((1methyl1Hindol3yl)methylidene)2sulfanylpyrimidine46(1H5H)dione
(5Z)1(4METHOXYPHENYL)5((1METHYLINDOL3YL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
312915416
COc1ccc(cc1)N1C(=NC(=O)C(=Cc2cn(c3c2cccc3)C)C1=O)S
InChI=1SC21H17N3O3Sc1231213(16534618(16)23)111719(25)2221(28)24(20(17)26)147915(272)10814h312H12H3(H222528)b1711
MFCD03799591
ZINC000004180982
ZINC4180982

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Available files

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