Vitas-M small molecule compound

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

Catalog ID
STK571794
SMILES COc1ccc(cc1)n1c(SCC(=O)Nc2cc(Cl)cc(c2)Cl)nnc1COc1ccc(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 C25H22Cl2N4O3S MW 529.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22Cl2N4O3S/c1-16-3-7-22(8-4-16)34-14-23-29-30-25(31(23)20-5-9-21(33-2)10-6-20)35-15-24(32)28-19-12-17(26)11-18(27)13-19/h3-13H,14-15H2,1-2H3,(H,28,32)
InChIKey
WCWNXHFDDBMYQQ-UHFFFAOYSA-N
Synonyms
861633-49-0
861633490
CC1=CC=C(C=C1)OCC2=NN=C(N2C3=CC=C(C=C3)OC)SCC(=O)NC4=CC(=CC(=C4)Cl)Cl
InChI=1SC25H22Cl2N4O3Sc1163722(8416)341423293025(31(23)205921(332)10620)351524(32)28191217(26)1118(27)1319h313H1415H212H3(H2832)
MFCD05685031
N(35DICHLOROPHENYL)2((4(4METHOXYPHENYL)5((4METHYLPHENOXY)METHYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(35dichlorophenyl)2((4(4methoxyphenyl)5((4methylphenoxy)methyl)4H124triazol3yl)sulfanyl)acetamide
N(35dichlorophenyl)2((4(4methoxyphenyl)5((ptolyloxy)methyl)4H124triazol3yl)thio)acetamide
N(35DICHLOROPHENYL)2((4(4METHOXYPHENYL)5(4METHYLPHENOXYMETHYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(35DICHLOROPHENYL)2(4(4METHOXYPHENYL)5((4METHYLPHENOXY)METHYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000097958443
ZINC97958443

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Available files

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