Vitas-M small molecule compound
(5E)-5-[(1-acetyl-1H-indol-3-yl)methylidene]-1-(4-methoxyphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK671293
SMILES COc1ccc(cc1)N1C(=S)NC(=O)/C(=C\c2cn(c3c2cccc3)C(=O)C)/C1=O
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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 C22H17N3O4S MW 419.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N3O4S/c1-13(26)24-12-14(17-5-3-4-6-19(17)24)11-18-20(27)23-22(30)25(21(18)28)15-7-9-16(29-2)10-8-15/h3-12H,1-2H3,(H,23,27,30)/b18-11+InChIKey
MZCBTUKHBLHMNI-WOJGMQOQSA-NSynonyms
(5E)5((1acetyl1Hindol3yl)methylidene)1(4methoxyphenyl)2thioxodihydropyrimidine46(1H5H)dione
(5E)5((1ACETYLINDOL3YL)METHYLIDENE)1(4METHOXYPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
5((1ACETYL1HINDOL3YL)METHYLENE)1(4METHOXYPHENYL)2THIOXODIHYDRO46(1H5H)PYRIMIDINEDIONE
CC(=O)N1C=C(C2=CC=CC=C21)C=C3C(=O)NC(=S)N(C3=O)C4=CC=C(C=C4)OC
COc1ccc(cc1)N1C(=S)NC(=O)C(=Cc2cn(c3c2cccc3)C(=O)C)C1=O
InChI=1SC22H17N3O4Sc113(26)241214(17534619(17)24)111820(27)2322(30)25(21(18)28)157916(292)10815h312H12H3(H232730)b1811+
MFCD00747786
ZINC000000712440
ZINC00712440
ZINC712440
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