Vitas-M small molecule compound
methyl (1-{[4-(2,4-dichlorophenoxy)butanoyl]carbamothioyl}-3-oxopiperazin-2-yl)acetate
Catalog ID
STL064103
SMILES COC(=O)CC1C(=O)NCCN1C(=S)NC(=O)CCCOc1ccc(cc1Cl)Cl
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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 C18H21Cl2N3O5S MW 462.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21Cl2N3O5S/c1-27-16(25)10-13-17(26)21-6-7-23(13)18(29)22-15(24)3-2-8-28-14-5-4-11(19)9-12(14)20/h4-5,9,13H,2-3,6-8,10H2,1H3,(H,21,26)(H,22,24,29)InChIKey
FYQKLSFTPYQQBT-UHFFFAOYSA-NSynonyms
COC(=O)CC1C(=O)NCCN1C(=S)NC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl
InChI=1SC18H21Cl2N3O5Sc12716(25)101317(26)216723(13)18(29)2215(24)32828145411(19)912(14)20h45913H236810H21H3(H2126)(H222429)
methyl(1((4(24dichlorophenoxy)butanoyl)carbamothioyl)3oxopiperazin2yl)acetate
METHYL2(1(4(24DICHLOROPHENOXY)BUTANOYLCARBAMOTHIOYL)3OXOPIPERAZIN2YL)ACETATE
MFCD05084828
ZINC000012292504
ZINC000012292510
Check stock
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Check stock on Vitas-MAvailable files
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