Vitas-M small molecule compound
(5Z)-5-[(1-benzyl-1H-indol-3-yl)methylidene]-1-(2-methoxyphenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STL046668
SMILES COc1ccccc1N1C(=NC(=O)/C(=C/c2cn(c3c2cccc3)Cc2ccccc2)/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 C27H21N3O3S MW 467.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21N3O3S/c1-33-24-14-8-7-13-23(24)30-26(32)21(25(31)28-27(30)34)15-19-17-29(16-18-9-3-2-4-10-18)22-12-6-5-11-20(19)22/h2-15,17H,16H2,1H3,(H,28,31,34)/b21-15-InChIKey
AIGZGLDROBKEKV-QNGOZBTKSA-NSynonyms
374541-88-5(5Z)5((1benzyl1Hindol3yl)methylidene)1(2methoxyphenyl)2sulfanylpyrimidine46(1H5H)dione
(5Z)5((1BENZYLINDOL3YL)METHYLIDENE)1(2METHOXYPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
374541885
COc1ccccc1N1C(=NC(=O)C(=Cc2cn(c3c2cccc3)Cc2ccccc2)C1=O)S
InChI=1SC27H21N3O3Sc1332414871323(24)3026(32)21(25(31)2827(30)34)15191729(161893241018)2212651120(19)22h21517H16H21H3(H283134)b2115
MFCD03800655
ZINC000009353363
ZINC09353363
ZINC9353363
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