Vitas-M small molecule compound

propan-2-yl 4-{[3-cyano-4-(thiophen-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-3-oxobutanoate

Catalog ID
STK748821
SMILES N#Cc1c(SCC(=O)CC(=O)OC(C)C)nc2c(c1c1cccs1)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 C21H22N2O3S2 MW 414.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O3S2/c1-13(2)26-19(25)10-14(24)12-28-21-16(11-22)20(18-8-5-9-27-18)15-6-3-4-7-17(15)23-21/h5,8-9,13H,3-4,6-7,10,12H2,1-2H3
InChIKey
BMRBXVACDWAPEV-UHFFFAOYSA-N
Synonyms
290299-74-0
290299740
CC(C)OC(=O)CC(=O)CSC1=NC2=C(CCCC2)C(=C1C#N)C3=CC=CS3
InChI=1SC21H22N2O3S2c113(2)2619(25)1014(24)12282116(1122)20(188592718)15634717(15)2321h58913H34671012H212H3
isopropyl4((3cyano4(thiophen2yl)5678tetrahydroquinolin2yl)thio)3oxobutanoate
MFCD00743913
propan2yl4((3cyano4(thiophen2yl)5678tetrahydroquinolin2yl)sulfanyl)3oxobutanoate
propan2yl4((3cyano4thiophen2yl5678tetrahydroquinolin2yl)sulfanyl)3oxobutanoate
ZINC000002217907
ZINC02217907
ZINC2217907

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Available files

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