Vitas-M small molecule compound
(5E)-5-[(1-{4-[(4-chlorobenzyl)oxy]phenyl}-2,5-dimethyl-1H-pyrrol-3-yl)methylidene]-3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1,3-thiazolidine-2,4-dione
Catalog ID
STK153577
SMILES Clc1ccc(cc1)COc1ccc(cc1)n1c(C)cc(c1C)/C=C\1/SC(=O)N(C1=O)CC(=O)N1CCN(CC1)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 C35H33ClN4O4S MW 641.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H33ClN4O4S/c1-24-20-27(25(2)40(24)30-12-14-31(15-13-30)44-23-26-8-10-28(36)11-9-26)21-32-34(42)39(35(43)45-32)22-33(41)38-18-16-37(17-19-38)29-6-4-3-5-7-29/h3-15,20-21H,16-19,22-23H2,1-2H3/b32-21+InChIKey
IVXKMSOAIXYCEU-RUMWWMSVSA-NSynonyms
(5E)5((1(4((4CHLOROBENZYL)OXY)PHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)3(2OXO2(4PHENYLPIPERAZIN1YL)ETHYL)13THIAZOLIDINE24DIONE
(5E)5((1(4((4CHLOROPHENYL)METHOXY)PHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)3(2OXO2(4PHENYLPIPERAZIN1YL)ETHYL)13THIAZOLIDINE24DIONE
5((1(4((4CHLOROBENZYL)OXY)PHENYL)25DIMETHYL1HPYRROL3YL)METHYLENE)3(2OXO2(4PHENYL1PIPERAZINYL)ETHYL)13THIAZOLIDINE24DIONE
CC1=CC(=C(N1C2=CC=C(C=C2)OCC3=CC=C(C=C3)Cl)C)C=C4C(=O)N(C(=O)S4)CC(=O)N5CCN(CC5)C6=CC=CC=C6
Clc1ccc(cc1)COc1ccc(cc1)n1c(C)cc(c1C)C=C1SC(=O)N(C1=O)CC(=O)N1CCN(CC1)c1ccccc1
InChI=1SC35H33ClN4O4Sc1242027(25(2)40(24)30121431(151330)44232681028(36)11926)213234(42)39(35(43)4532)2233(41)38181637(171938)296435729h3152021H16192223H212H3b3221+
MFCD03272455
ZINC000008450529
ZINC08450529
ZINC8450529
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