Vitas-M small molecule compound

methyl 4-methyl-3-({[(2-methylbenzyl)sulfanyl]acetyl}amino)benzoate

Catalog ID
STL199798
SMILES COC(=O)c1ccc(c(c1)NC(=O)CSCc1ccccc1C)C

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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 C19H21NO3S MW 343.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21NO3S/c1-13-6-4-5-7-16(13)11-24-12-18(21)20-17-10-15(19(22)23-3)9-8-14(17)2/h4-10H,11-12H2,1-3H3,(H,20,21)
InChIKey
NGWNCPCYTVEGPZ-UHFFFAOYSA-N
Synonyms

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CSCC2=CC=CC=C2C
InChI=1SC19H21NO3Sc113645716(13)11241218(21)20171015(19(22)233)9814(17)2h410H1112H213H3(H2021)
methyl4methyl3((((2methylbenzyl)sulfanyl)acetyl)amino)benzoate
METHYL4METHYL3((2((2METHYLPHENYL)METHYLSULFANYL)ACETYL)AMINO)BENZOATE
MFCD03068679
ZINC000000980245
ZINC00980245
ZINC980245

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Available files

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