Vitas-M small molecule compound

methyl [(4-methyl-5-{[(2-methylquinolin-8-yl)oxy]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetate

Catalog ID
STK807467
SMILES COC(=O)CSc1nnc(n1C)COc1cccc2c1nc(C)cc2

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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 C17H18N4O3S MW 358.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N4O3S/c1-11-7-8-12-5-4-6-13(16(12)18-11)24-9-14-19-20-17(21(14)2)25-10-15(22)23-3/h4-8H,9-10H2,1-3H3
InChIKey
IMKDVLKQIAQGST-UHFFFAOYSA-N
Synonyms

CC1=NC2=C(C=CC=C2OCC3=NN=C(N3C)SCC(=O)OC)C=C1
InChI=1SC17H18N4O3Sc111781254613(16(12)1811)24914192017(21(14)2)251015(22)233h48H910H213H3
methyl((4methyl5(((2methylquinolin8yl)oxy)methyl)4H124triazol3yl)sulfanyl)acetate
METHYL2((4METHYL5((2METHYLQUINOLIN8YL)OXYMETHYL)124TRIAZOL3YL)SULFANYL)ACETATE
METHYL2(4METHYL5((2METHYL(8QUINOLYLOXY))METHYL)124TRIAZOL3YLTHIO)ACETATE
MFCD04444569
ZINC000001454320
ZINC01454320
ZINC1454320

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Available files

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