Vitas-M small molecule compound
propan-2-yl 3-({(2E,5E)-5-[3-bromo-5-methoxy-4-(prop-2-yn-1-yloxy)benzylidene]-4-oxo-1,3-thiazolidin-2-ylidene}amino)benzoate
Catalog ID
STK142015
SMILES C#CCOc1c(Br)cc(cc1OC)/C=C\1/S/C(=N/c2cccc(c2)C(=O)OC(C)C)/NC1=O
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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 C24H21BrN2O5S MW 529.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21BrN2O5S/c1-5-9-31-21-18(25)10-15(11-19(21)30-4)12-20-22(28)27-24(33-20)26-17-8-6-7-16(13-17)23(29)32-14(2)3/h1,6-8,10-14H,9H2,2-4H3,(H,26,27,28)/b20-12+InChIKey
RTBJKCKVGZAWCX-UDWIEESQSA-NSynonyms
C#CCOc1c(Br)cc(cc1OC)C=C1SC(=Nc2cccc(c2)C(=O)OC(C)C)NC1=O
CC(C)OC(=O)C1=CC(=CC=C1)NC2=NC(=O)C(=CC3=CC(=C(C(=C3)Br)OCC#C)OC)S2
InChI=1SC24H21BrN2O5Sc159312118(25)1015(1119(21)304)122022(28)2724(3320)261786716(1317)23(29)3214(2)3h1681014H9H224H3(H262728)b2012+
ISOPROPYL3((5(3BROMO5METHOXY4(2PROPYNYLOXY)BENZYLIDENE)4OXO13THIAZOLIDIN2YLIDENE)AMINO)BENZOATE
MFCD08675020
PROPAN2YL3(((2E5E)5(3BROMO5METHOXY4(PROP2YN1YLOXY)BENZYLIDENE)4OXO13THIAZOLIDIN2YLIDENE)AMINO)BENZOATE
PROPAN2YL3(((5E)5((3BROMO5METHOXY4PROP2YNOXYPHENYL)METHYLIDENE)4OXO13THIAZOL2YL)AMINO)BENZOATE
ZINC000008437823
ZINC08437823
ZINC8437823
Check stock
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Check stock on Vitas-MAvailable files
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