Vitas-M small molecule compound
2-(diethylamino)ethyl 4-({[(2E)-3-(4-fluorophenyl)prop-2-enoyl]carbamothioyl}amino)benzoate
Catalog ID
STK332628
SMILES CCN(CCOC(=O)c1ccc(cc1)NC(=S)NC(=O)/C=C/c1ccc(cc1)F)CC
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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 C23H26FN3O3S MW 443.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26FN3O3S/c1-3-27(4-2)15-16-30-22(29)18-8-12-20(13-9-18)25-23(31)26-21(28)14-7-17-5-10-19(24)11-6-17/h5-14H,3-4,15-16H2,1-2H3,(H2,25,26,28,31)/b14-7+InChIKey
PZCMITMBCQEGFR-VGOFMYFVSA-NSynonyms
2(diethylamino)ethyl4((((2E)3(4fluorophenyl)prop2enoyl)carbamothioyl)amino)benzoate
2(diethylamino)ethyl4(((E)3(4fluorophenyl)prop2enoyl)carbamothioylamino)benzoate
CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C=CC2=CC=C(C=C2)F
CCN(CCOC(=O)c1ccc(cc1)NC(=S)NC(=O)C=Cc1ccc(cc1)F)CC
InChI=1SC23H26FN3O3Sc1327(42)15163022(29)1881220(13918)2523(31)2621(28)1471751019(24)11617h514H341516H212H3(H225262831)b147+
MFCD00288712
ZINC000018195198
ZINC18195198
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