Vitas-M small molecule compound

dimethyl 2-({[(4-bromobenzyl)sulfanyl]acetyl}amino)benzene-1,4-dicarboxylate

Catalog ID
STK357750
SMILES COC(=O)c1ccc(cc1NC(=O)CSCc1ccc(cc1)Br)C(=O)OC

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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 C19H18BrNO5S MW 452.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18BrNO5S/c1-25-18(23)13-5-8-15(19(24)26-2)16(9-13)21-17(22)11-27-10-12-3-6-14(20)7-4-12/h3-9H,10-11H2,1-2H3,(H,21,22)
InChIKey
IUYGKYJUKMVJCK-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)CSCC2=CC=C(C=C2)Br
DIMETHYL2((((4BROMOBENZYL)SULFANYL)ACETYL)AMINO)BENZENE14DICARBOXYLATE
DIMETHYL2((((4BROMOBENZYL)THIO)ACETYL)AMINO)TEREPHTHALATE
DIMETHYL2((2((4BROMOPHENYL)METHYLSULFANYL)ACETYL)AMINO)BENZENE14DICARBOXYLATE
InChI=1SC19H18BrNO5Sc12518(23)135815(19(24)262)16(913)2117(22)112710123614(20)7412h39H1011H212H3(H2122)
MFCD06629073
ZINC000002882323
ZINC02882323
ZINC2882323

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Available files

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