Vitas-M small molecule compound

[(3-butyl-8-methoxy-2-methylquinolin-4-yl)sulfanyl]acetic acid

Catalog ID
STK052849
SMILES CCCCc1c(C)nc2c(c1SCC(=O)O)cccc2OC

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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 C17H21NO3S MW 319.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21NO3S/c1-4-5-7-12-11(2)18-16-13(8-6-9-14(16)21-3)17(12)22-10-15(19)20/h6,8-9H,4-5,7,10H2,1-3H3,(H,19,20)
InChIKey
HFTGYICHDHHCTL-UHFFFAOYSA-N
Synonyms
330827-48-0
((3BUTYL8METHOXY2METHYLQUINOLIN4YL)SULFANYL)ACETICACID
(3BUTYL8METHOXY2METHYLQUINOLIN4YLSULFANYL)ACETICACID
2((3BUTYL8METHOXY2METHYL4QUINOLINYL)THIO)ACETICACID
2((3BUTYL8METHOXY2METHYL4QUINOLYL)THIO)ACETICACID
2((3butyl8methoxy2methylquinolin4yl)thio)aceticacid
2(3BUTYL8METHOXY2METHYLQUINOLIN4YL)SULFANYLACETICACID
2(3BUTYL8METHOXY2METHYLQUINOLIN4YL)SULFANYLETHANOICACID
330827480
CCCCC1=C(C2=C(C(=CC=C2)OC)N=C1C)SCC(=O)O
CCCCc1c(C)nc2c(c1SCC(=O)O)cccc2OC
InChI=1SC17H21NO3Sc14571211(2)181613(86914(16)213)17(12)221015(19)20h689H45710H213H3(H1920)
MFCD01957674
STK052849
ZINC000004825504
ZINC4825504

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Available files

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