Vitas-M small molecule compound

methyl 3-{[(benzylsulfanyl)acetyl]amino}benzoate

Catalog ID
STK156312
SMILES COC(=O)c1cccc(c1)NC(=O)CSCc1ccccc1

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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 C17H17NO3S MW 315.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17NO3S/c1-21-17(20)14-8-5-9-15(10-14)18-16(19)12-22-11-13-6-3-2-4-7-13/h2-10H,11-12H2,1H3,(H,18,19)
InChIKey
SCKJKOXVBFZDGA-UHFFFAOYSA-N
Synonyms
309283-64-5
3(2BENZYLSULFANYLACETYLAMINO)BENZOICACIDMETHYLESTER
309283645
COC(=O)C1=CC(=CC=C1)NC(=O)CSCC2=CC=CC=C2
InChI=1SC17H17NO3Sc12117(20)1485915(1014)1816(19)122211136324713h210H1112H21H3(H1819)
METHYL3(((BENZYLSULFANYL)ACETYL)AMINO)BENZOATE
METHYL3((2BENZYLSULFANYLACETYL)AMINO)BENZOATE
METHYL3(2(PHENYLMETHYLTHIO)ACETYLAMINO)BENZOATE
MFCD01604679
ZINC000000053008
ZINC00053008
ZINC53008

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Available files

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