Vitas-M small molecule compound
ethyl (5Z)-5-{5-bromo-2-[(2,4-dichlorobenzyl)oxy]benzylidene}-4-oxo-2-[(phenylcarbonyl)amino]-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STL380508
SMILES CCOC(=O)C1=C(S/C(=C\c2cc(Br)ccc2OCc2ccc(cc2Cl)Cl)/C1=O)NC(=O)c1ccccc1
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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 C28H20BrCl2NO5S MW 633.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H20BrCl2NO5S/c1-2-36-28(35)24-25(33)23(38-27(24)32-26(34)16-6-4-3-5-7-16)13-18-12-19(29)9-11-22(18)37-15-17-8-10-20(30)14-21(17)31/h3-14H,2,15H2,1H3,(H,32,34)/b23-13-InChIKey
VHVRKWUZNBGDPF-QRVIBDJDSA-NSynonyms
CCOC(=O)C1=C(SC(=CC2=C(C=CC(=C2)Br)OCC3=C(C=C(C=C3)Cl)Cl)C1=O)NC(=O)C4=CC=CC=C4
CCOC(=O)C1=C(SC(=Cc2cc(Br)ccc2OCc2ccc(cc2Cl)Cl)C1=O)NC(=O)c1ccccc1
ETHYL(5Z)2BENZAMIDO5((5BROMO2((24DICHLOROPHENYL)METHOXY)PHENYL)METHYLIDENE)4OXOTHIOPHENE3CARBOXYLATE
ethyl(5Z)5(5bromo2((24dichlorobenzyl)oxy)benzylidene)4oxo2((phenylcarbonyl)amino)45dihydrothiophene3carboxylate
ETHYL2(BENZOYLAMINO)5(5BROMO2((24DICHLOROBENZYL)OXY)BENZYLIDENE)4OXO45DIHYDRO3THIOPHENECARBOXYLATE
InChI=1SC28H20BrCl2NO5Sc123628(35)2425(33)23(3827(24)3226(34)166435716)13181219(29)91122(18)37151781020(30)1421(17)31h314H215H21H3(H3234)b2313
MFCD03784004
ZINC000008396271
ZINC08396271
ZINC8396271
Check stock
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Check stock on Vitas-MAvailable files
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