Vitas-M small molecule compound

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

Catalog ID
STL055112
SMILES O=C(Nc1ccc(c(c1)F)C)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 C24H23FN4O3S MW 466.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23FN4O3S/c1-16-5-9-19(10-6-16)32-14-22-27-28-24(29(22)13-20-4-3-11-31-20)33-15-23(30)26-18-8-7-17(2)21(25)12-18/h3-12H,13-15H2,1-2H3,(H,26,30)
InChIKey
WZOHUCZYJQNXES-UHFFFAOYSA-N
Synonyms
861651-93-6
861651936
CC1=CC=C(C=C1)OCC2=NN=C(N2CC3=CC=CO3)SCC(=O)NC4=CC(=C(C=C4)C)F
InChI=1SC24H23FN4O3Sc1165919(10616)321422272824(29(22)132043113120)331523(30)26188717(2)21(25)1218h312H1315H212H3(H2630)
MFCD05686529
N(3FLUORO4METHYLPHENYL)2((4(FURAN2YLMETHYL)5((4METHYLPHENOXY)METHYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(3fluoro4methylphenyl)2((4(furan2ylmethyl)5((4methylphenoxy)methyl)4H124triazol3yl)sulfanyl)acetamide
N(3fluoro4methylphenyl)2((4(furan2ylmethyl)5((ptolyloxy)methyl)4H124triazol3yl)thio)acetamide
N(3FLUORO4METHYLPHENYL)2((4(FURAN2YLMETHYL)5(4METHYLPHENOXYMETHYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(3FLUORO4METHYLPHENYL)2(4(2FURYLMETHYL)5((4METHYLPHENOXY)METHYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000009497416
ZINC09497416
ZINC9497416

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Available files

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