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Vitas-M small molecule compound

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

Catalog ID
STK142070
SMILES CCn1c(SCC(=O)Nc2ccc(c(c2)C)C)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 C22H26N4O2S MW 410.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N4O2S/c1-5-26-20(13-28-19-10-6-15(2)7-11-19)24-25-22(26)29-14-21(27)23-18-9-8-16(3)17(4)12-18/h6-12H,5,13-14H2,1-4H3,(H,23,27)
InChIKey
VFDPSEKTOYYICU-UHFFFAOYSA-N
Synonyms
694507-07-8
694507078
CCN1C(=NN=C1SCC(=O)NC2=CC(=C(C=C2)C)C)COC3=CC=C(C=C3)C
InChI=1SC22H26N4O2Sc152620(13281910615(2)71119)242522(26)291421(27)23189816(3)17(4)1218h612H51314H214H3(H2327)
MFCD04215096
N(34DIMETHYLPHENYL)2((4ETHYL5((4METHYLPHENOXY)METHYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(34DIMETHYLPHENYL)2((4ETHYL5((4METHYLPHENOXY)METHYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(34dimethylphenyl)2((4ethyl5((ptolyloxy)methyl)4H124triazol3yl)thio)acetamide
N(34DIMETHYLPHENYL)2((4ETHYL5(4METHYLPHENOXYMETHYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(34DIMETHYLPHENYL)2(4ETHYL5((4METHYLPHENOXY)METHYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000001111817
ZINC01111817
ZINC1111817

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Available files

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

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