Vitas-M small molecule compound

methyl 3-[3-(phenylsulfanyl)-1H-indol-2-yl]propanoate

Catalog ID
STK017050
SMILES COC(=O)CCc1[nH]c2c(c1Sc1ccccc1)cccc2

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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 C18H17NO2S MW 311.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17NO2S/c1-21-17(20)12-11-16-18(22-13-7-3-2-4-8-13)14-9-5-6-10-15(14)19-16/h2-10,19H,11-12H2,1H3
InChIKey
LZSQQWLNWAMWTO-UHFFFAOYSA-N
Synonyms
329209-37-2
3(3PHENYLSULFANYL1HINDOL2YL)PROPIONICACIDMETHYLESTER
329209372
COC(=O)CCc1(nH)c2c(c1Sc1ccccc1)cccc2
COC(=O)CCC1=C(C2=CC=CC=C2N1)SC3=CC=CC=C3
InChI=1SC18H17NO2Sc12117(20)12111618(22137324813)149561015(14)1916h21019H1112H21H3
METHYL3(3(PHENYLSULFANYL)1HINDOL2YL)PROPANOATE
methyl3(3(phenylthio)1Hindol2yl)propanoate
METHYL3(3PHENYLSULFANYL1HINDOL2YL)PROPANOATE
METHYL3(3PHENYLTHIOINDOL2YL)PROPANOATE
MFCD00409368
STK017050
ZINC000000036658
ZINC00036658
ZINC36658

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Available files

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