Vitas-M small molecule compound

4-[(5Z)-5-(4-bromobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-(2-chlorophenyl)butanamide

Catalog ID
STK994549
SMILES O=C(Nc1ccccc1Cl)CCCN1C(=S)S/C(=C\c2ccc(cc2)Br)/C1=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 C20H16BrClN2O2S2 MW 495.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16BrClN2O2S2/c21-14-9-7-13(8-10-14)12-17-19(26)24(20(27)28-17)11-3-6-18(25)23-16-5-2-1-4-15(16)22/h1-2,4-5,7-10,12H,3,6,11H2,(H,23,25)/b17-12-
InChIKey
MRIYLRUTQCTIBO-ATVHPVEESA-N
Synonyms

4((5Z)5((4bromophenyl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)N(2chlorophenyl)butanamide
4((5Z)5(4bromobenzylidene)4oxo2thioxo13thiazolidin3yl)N(2chlorophenyl)butanamide
C1=CC=C(C(=C1)NC(=O)CCCN2C(=O)C(=CC3=CC=C(C=C3)Br)SC2=S)Cl
InChI=1SC20H16BrClN2O2S2c21149713(81014)121719(26)24(20(27)2817)113618(25)2316521415(16)22h124571012H3611H2(H2325)b1712
MFCD02655301
O=C(Nc1ccccc1Cl)CCCN1C(=S)SC(=Cc2ccc(cc2)Br)C1=O
ZINC000008871690
ZINC08871690
ZINC8871690

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Available files

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