Vitas-M small molecule compound

2-methyl-8-{[5-(methylsulfanyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]methoxy}quinoline

Catalog ID
STK807411
SMILES C=CCn1c(COc2cccc3c2nc(C)cc3)nnc1SC

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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 C17H18N4OS MW 326.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N4OS/c1-4-10-21-15(19-20-17(21)23-3)11-22-14-7-5-6-13-9-8-12(2)18-16(13)14/h4-9H,1,10-11H2,2-3H3
InChIKey
XSOUZCVFQGFOHW-UHFFFAOYSA-N
Synonyms

2methyl8((5(methylsulfanyl)4(prop2en1yl)4H124triazol3yl)methoxy)quinoline
2METHYL8((5METHYLSULFANYL4PROP2ENYL124TRIAZOL3YL)METHOXY)QUINOLINE
2METHYL8((5METHYLTHIO4PROP2ENYL(124TRIAZOL3YL))METHOXY)QUINOLINE
CC1=NC2=C(C=CC=C2OCC3=NN=C(N3CC=C)SC)C=C1
InChI=1SC17H18N4OSc14102115(192017(21)233)112214756139812(2)1816(13)14h49H11011H223H3
MFCD04218496
ZINC000000619888
ZINC00619888
ZINC619888

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Available files

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