Vitas-M small molecule compound

(2Z)-2-[(5E)-5-(3-bromobenzylidene)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-N-(2-chlorophenyl)-2-cyanoethanamide

Catalog ID
STK740714
SMILES N#C/C(=c\1/s/c(=C/c2cccc(c2)Br)/c(=O)n1c1ccccc1)/C(=O)Nc1ccccc1Cl

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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 C25H15BrClN3O2S MW 536.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H15BrClN3O2S/c26-17-8-6-7-16(13-17)14-22-24(32)30(18-9-2-1-3-10-18)25(33-22)19(15-28)23(31)29-21-12-5-4-11-20(21)27/h1-14H,(H,29,31)/b22-14+,25-19-
InChIKey
ACVZZESHJCDOOD-XQWBXMLZSA-N
Synonyms

(2Z)2((5E)5((3BROMOPHENYL)METHYLIDENE)4OXO3PHENYL13THIAZOLIDIN2YLIDENE)N(2CHLOROPHENYL)2CYANOACETAMIDE
(2Z)2((5E)5(3bromobenzylidene)4oxo3phenyl13thiazolidin2ylidene)N(2chlorophenyl)2cyanoethanamide
(E)2((E)5(3bromobenzylidene)4oxo3phenylthiazolidin2ylidene)N(2chlorophenyl)2cyanoacetamide
2(5((3BROMOPHENYL)METHYLENE)4OXO3PHENYL(13THIAZOLIDIN2YLIDENE))N(2CHLOROPHENYL)2CYANOACETAMIDE
C1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=CC=C3)Br)SC2=C(C#N)C(=O)NC4=CC=CC=C4Cl
InChI=1SC25H15BrClN3O2Sc261786716(1317)142224(32)30(1892131018)25(3322)19(1528)23(31)292112541120(21)27h114H(H2931)b2214+2519
MFCD06438536
N#CC(=c1sc(=Cc2cccc(c2)Br)c(=O)n1c1ccccc1)C(=O)Nc1ccccc1Cl
ZINC000100989111
ZINC100989111

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.