Vitas-M small molecule compound
1-[(2Z)-5-{[4-(butan-2-yl)phenoxy]methyl}-1,3,4-thiadiazol-2(3H)-ylidene]-3-(3-chlorophenyl)urea
Catalog ID
STK600995
SMILES CCC(c1ccc(cc1)OCc1n[nH]/c(=N/C(=O)Nc2cccc(c2)Cl)/s1)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 C20H21ClN4O2S MW 416.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21ClN4O2S/c1-3-13(2)14-7-9-17(10-8-14)27-12-18-24-25-20(28-18)23-19(26)22-16-6-4-5-15(21)11-16/h4-11,13H,3,12H2,1-2H3,(H2,22,23,25,26)InChIKey
QRRHVNBZWWIWCV-UHFFFAOYSA-NSynonyms
488102-45-0488102450
CCC(c1ccc(cc1)OCc1n(nH)c(=NC(=O)Nc2cccc(c2)Cl)s1)C
MFCD08732347
ZINC000008737912
ZINC000008737913
Check stock
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Check stock on Vitas-MAvailable files
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