Vitas-M small molecule compound
ethyl 5-({[(2-chlorophenyl)carbonyl]carbamothioyl}amino)-2-(morpholin-4-yl)benzoate
Catalog ID
STK205684
SMILES CCOC(=O)c1cc(ccc1N1CCOCC1)NC(=S)NC(=O)c1ccccc1Cl
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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 C21H22ClN3O4S MW 447.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22ClN3O4S/c1-2-29-20(27)16-13-14(7-8-18(16)25-9-11-28-12-10-25)23-21(30)24-19(26)15-5-3-4-6-17(15)22/h3-8,13H,2,9-12H2,1H3,(H2,23,24,26,30)InChIKey
MSFVTHZIROPSKK-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(C=CC(=C1)NC(=S)NC(=O)C2=CC=CC=C2Cl)N3CCOCC3
ETHYL5((((2CHLOROPHENYL)CARBONYL)CARBAMOTHIOYL)AMINO)2(MORPHOLIN4YL)BENZOATE
ethyl5((2chlorobenzoyl)carbamothioylamino)2morpholin4ylbenzoate
InChI=1SC21H22ClN3O4Sc122920(27)161314(7818(16)2591128121025)2321(30)2419(26)15534617(15)22h3813H2912H21H3(H223242630)
MFCD06666738
ZINC000009971578
ZINC09971578
ZINC9971578
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