Vitas-M small molecule compound
(5Z)-5-[(1-methyl-1H-indol-3-yl)methylidene]-1-(2-methylphenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STL045328
SMILES O=C1N=C(S)N(C(=O)/C/1=C\c1cn(c2c1cccc2)C)c1ccccc1C
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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 C21H17N3O2S MW 375.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N3O2S/c1-13-7-3-5-9-17(13)24-20(26)16(19(25)22-21(24)27)11-14-12-23(2)18-10-6-4-8-15(14)18/h3-12H,1-2H3,(H,22,25,27)/b16-11-InChIKey
ZCEOQMJLITZBEP-WJDWOHSUSA-NSynonyms
372494-41-2(5Z)5((1methyl1Hindol3yl)methylidene)1(2methylphenyl)2sulfanylpyrimidine46(1H5H)dione
(5Z)5((1METHYLINDOL3YL)METHYLIDENE)1(2METHYLPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
372494412
CC1=CC=CC=C1N2C(=O)C(=CC3=CN(C4=CC=CC=C43)C)C(=O)NC2=S
InChI=1SC21H17N3O2Sc113735917(13)2420(26)16(19(25)2221(24)27)11141223(2)181064815(14)18h312H12H3(H222527)b1611
MFCD03806223
O=C1N=C(S)N(C(=O)C1=Cc1cn(c2c1cccc2)C)c1ccccc1C
ZINC000006898410
ZINC06898410
ZINC6898410
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