Vitas-M small molecule compound
(5Z)-1-(2-methoxyphenyl)-5-[(1-methyl-1H-indol-3-yl)methylidene]-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STL047615
SMILES COc1ccccc1N1C(=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(14-7-3-4-8-16(14)23)11-15-19(25)22-21(28)24(20(15)26)17-9-5-6-10-18(17)27-2/h3-12H,1-2H3,(H,22,25,28)/b15-11-InChIKey
XBXSMLAXYWZVGC-PTNGSMBKSA-NSynonyms
372979-74-3(5Z)1(2methoxyphenyl)5((1methyl1Hindol3yl)methylidene)2sulfanylpyrimidine46(1H5H)dione
(5Z)1(2METHOXYPHENYL)5((1METHYLINDOL3YL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
372979743
CN1C=C(C2=CC=CC=C21)C=C3C(=O)NC(=S)N(C3=O)C4=CC=CC=C4OC
COc1ccccc1N1C(=NC(=O)C(=Cc2cn(c3c2cccc3)C)C1=O)S
InChI=1SC21H17N3O3Sc1231213(14734816(14)23)111519(25)2221(28)24(20(15)26)179561018(17)272h312H12H3(H222528)b1511
MFCD03800298
ZINC000001302432
ZINC1302432
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