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methyl {(4E)-4-[(2E)-(5-{2-[(4-bromophenyl)amino]-2-oxoethyl}-4-oxo-1,3-thiazolidin-2-ylidene)hydrazinylidene]-2-oxo-1,3-thiazolidin-5-yl}acetate

Catalog ID
STK550183
SMILES COC(=O)CC1SC(=O)N/C/1=N/N=C/1\NC(=O)C(S1)CC(=O)Nc1ccc(cc1)Br

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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 C17H16BrN5O5S2 MW 514.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16BrN5O5S2/c1-28-13(25)7-10-14(20-17(27)30-10)22-23-16-21-15(26)11(29-16)6-12(24)19-9-4-2-8(18)3-5-9/h2-5,10-11H,6-7H2,1H3,(H,19,24)(H,20,22,27)(H,21,23,26)
InChIKey
NSZWILXHNFACMM-UHFFFAOYSA-N
Synonyms
501112-42-1
501112421
COC(=O)CC1C(=NC(=O)S1)NNC2=NC(=O)C(S2)CC(=O)NC3=CC=C(C=C3)Br
COC(=O)CC1SC(=O)NC1=NN=C1NC(=O)C(S1)CC(=O)Nc1ccc(cc1)Br
InChI=1SC17H16BrN5O5S2c12813(25)71014(2017(27)3010)2223162115(26)11(2916)612(24)199428(18)359h251011H67H21H3(H1924)(H202227)(H212326)
methyl((4E)4((2E)(5(2((4bromophenyl)amino)2oxoethyl)4oxo13thiazolidin2ylidene)hydrazinylidene)2oxo13thiazolidin5yl)acetate
methyl2((E)4((E)(5(2((4bromophenyl)amino)2oxoethyl)4oxothiazolidin2ylidene)hydrazono)2oxothiazolidin5yl)acetate
METHYL2(4(2(5((N(4BROMOPHENYL)CARBAMOYL)METHYL)4OXO(13THIAZOLIDIN2YLIDENE))12DIAZAETHYLIDENE)2OXO13THIAZOLIDIN5YL)ACETATE
METHYL2(4(2(5(2(4BROMOANILINO)2OXOETHYL)4OXO13THIAZOL2YL)HYDRAZINYL)2OXO5H13THIAZOL5YL)ACETATE
MFCD03621049
ZINC000009428436
ZINC000013688361

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Available files

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