Vitas-M small molecule compound
[(3-butyl-8-chloro-2-methylquinolin-4-yl)sulfanyl]acetic acid
Catalog ID
STK053493
SMILES CCCCc1c(C)nc2c(c1SCC(=O)O)cccc2Cl
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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 C16H18ClNO2S MW 323.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18ClNO2S/c1-3-4-6-11-10(2)18-15-12(7-5-8-13(15)17)16(11)21-9-14(19)20/h5,7-8H,3-4,6,9H2,1-2H3,(H,19,20)InChIKey
BTYTVSLGBTYTQA-UHFFFAOYSA-NSynonyms
((3BUTYL8CHLORO2METHYLQUINOLIN4YL)SULFANYL)ACETICACID
2(3BUTYL8CHLORO2METHYLQUINOLIN4YL)SULFANYLACETICACID
CCCCC1=C(C2=C(C(=CC=C2)Cl)N=C1C)SCC(=O)O
CCCCc1c(C)nc2c(c1SCC(=O)O)cccc2Cl
InChI=1SC16H18ClNO2Sc13461110(2)181512(75813(15)17)16(11)21914(19)20h578H3469H212H3(H1920)
MFCD08051211
STK053493
ZINC000006138465
ZINC6138465
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