Vitas-M small molecule compound

methyl 3-{[(benzylsulfanyl)acetyl]amino}-4-chlorobenzoate

Catalog ID
STL222463
SMILES COC(=O)c1ccc(c(c1)NC(=O)CSCc1ccccc1)Cl

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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 C17H16ClNO3S MW 349.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16ClNO3S/c1-22-17(21)13-7-8-14(18)15(9-13)19-16(20)11-23-10-12-5-3-2-4-6-12/h2-9H,10-11H2,1H3,(H,19,20)
InChIKey
QLNYFXHQBHAYFC-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CC(=C(C=C1)Cl)NC(=O)CSCC2=CC=CC=C2
InChI=1SC17H16ClNO3Sc12217(21)137814(18)15(913)1916(20)112310125324612h29H1011H21H3(H1920)
methyl3(((benzylsulfanyl)acetyl)amino)4chlorobenzoate
METHYL3((2BENZYLSULFANYLACETYL)AMINO)4CHLOROBENZOATE
MFCD04358337
ZINC000000563131
ZINC00563131
ZINC563131

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Available files

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