Vitas-M small molecule compound
(5E)-5-{[(1-benzylpiperidin-4-yl)amino]methylidene}-1-(butan-2-yl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STK594118
SMILES CCC(N1C(=NC(=O)/C(=C\NC2CCN(CC2)Cc2ccccc2)/C1=O)S)C
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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 C21H28N4O2S MW 400.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N4O2S/c1-3-15(2)25-20(27)18(19(26)23-21(25)28)13-22-17-9-11-24(12-10-17)14-16-7-5-4-6-8-16/h4-8,13,15,17,22H,3,9-12,14H2,1-2H3,(H,23,26,28)/b18-13+InChIKey
CYDPXCLDYSOXNI-QGOAFFKASA-NSynonyms
(5E)5(((1benzylpiperidin4yl)amino)methylidene)1(butan2yl)2sulfanylpyrimidine46(1H5H)dione(5E)5(((1benzylpiperidin4yl)amino)methylidene)1butan2yl2sulfanylidene13diazinane46dione
CCC(C)N1C(=O)C(=CNC2CCN(CC2)CC3=CC=CC=C3)C(=O)NC1=S
CCC(N1C(=NC(=O)C(=CNC2CCN(CC2)Cc2ccccc2)C1=O)S)C
Registry IDs
MFCD07201323ZINC000020533317
ZINC000020533318
Check stock
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Check stock on Vitas-MAvailable files
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