Vitas-M small molecule compound

methyl 3-({[(2-chloro-6-fluorobenzyl)sulfanyl]acetyl}amino)-2-methylbenzoate

Catalog ID
STL101482
SMILES COC(=O)c1cccc(c1C)NC(=O)CSCc1c(F)cccc1Cl

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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 C18H17ClFNO3S MW 381.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17ClFNO3S/c1-11-12(18(23)24-2)5-3-8-16(11)21-17(22)10-25-9-13-14(19)6-4-7-15(13)20/h3-8H,9-10H2,1-2H3,(H,21,22)
InChIKey
BLIPOXBJMZPOEV-UHFFFAOYSA-N
Synonyms

CC1=C(C=CC=C1NC(=O)CSCC2=C(C=CC=C2Cl)F)C(=O)OC
InChI=1SC18H17ClFNO3Sc11112(18(23)242)53816(11)2117(22)102591314(19)64715(13)20h38H910H212H3(H2122)
methyl3((((2chloro6fluorobenzyl)sulfanyl)acetyl)amino)2methylbenzoate
METHYL3((2((2CHLORO6FLUOROPHENYL)METHYLSULFANYL)ACETYL)AMINO)2METHYLBENZOATE
MFCD06625460
ZINC000002873739
ZINC02873739
ZINC2873739

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Available files

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