Vitas-M small molecule compound

N-(3,4-difluorophenyl)-2-({4-(furan-2-ylmethyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide

Catalog ID
STL042707
SMILES O=C(Nc1ccc(c(c1)F)F)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)C

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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 C23H20F2N4O3S MW 470.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20F2N4O3S/c1-15-4-7-17(8-5-15)32-13-21-27-28-23(29(21)12-18-3-2-10-31-18)33-14-22(30)26-16-6-9-19(24)20(25)11-16/h2-11H,12-14H2,1H3,(H,26,30)
InChIKey
FGSNQRSNJQHDFD-UHFFFAOYSA-N
Synonyms
861643-38-1
861643381
CC1=CC=C(C=C1)OCC2=NN=C(N2CC3=CC=CO3)SCC(=O)NC4=CC(=C(C=C4)F)F
InChI=1SC23H20F2N4O3Sc1154717(8515)321321272823(29(21)121832103118)331422(30)26166919(24)20(25)1116h211H1214H21H3(H2630)
MFCD05685906
N(34DIFLUOROPHENYL)2((4(FURAN2YLMETHYL)5((4METHYLPHENOXY)METHYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(34difluorophenyl)2((4(furan2ylmethyl)5((4methylphenoxy)methyl)4H124triazol3yl)sulfanyl)acetamide
N(34difluorophenyl)2((4(furan2ylmethyl)5((ptolyloxy)methyl)4H124triazol3yl)thio)acetamide
N(34DIFLUOROPHENYL)2((4(FURAN2YLMETHYL)5(4METHYLPHENOXYMETHYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(34DIFLUOROPHENYL)2(4(2FURYLMETHYL)5((4METHYLPHENOXY)METHYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000009480117
ZINC09480117
ZINC9480117

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Available files

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