Vitas-M small molecule compound

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

Catalog ID
STK142100
SMILES CCn1c(SCC(=O)Nc2ccccc2Cl)nnc1COc1cccc(c1)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 C20H21ClN4O2S MW 416.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21ClN4O2S/c1-3-25-18(12-27-15-8-6-7-14(2)11-15)23-24-20(25)28-13-19(26)22-17-10-5-4-9-16(17)21/h4-11H,3,12-13H2,1-2H3,(H,22,26)
InChIKey
UKHYVOPNYLFNDM-UHFFFAOYSA-N
Synonyms

CCN1C(=NN=C1SCC(=O)NC2=CC=CC=C2Cl)COC3=CC=CC(=C3)C
InChI=1SC20H21ClN4O2Sc132518(12271586714(2)1115)232420(25)281319(26)22171054916(17)21h411H31213H212H3(H2226)
MFCD03047965
N(2CHLOROPHENYL)2((4ETHYL5((3METHYLPHENOXY)METHYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(2CHLOROPHENYL)2((4ETHYL5((3METHYLPHENOXY)METHYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(2CHLOROPHENYL)2((4ETHYL5((3METHYLPHENOXY)METHYL)4H124TRIAZOL3YL)THIO)ACETAMIDE
N(2CHLOROPHENYL)2(4ETHYL5((3METHYLPHENOXY)METHYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000000687574
ZINC00687574
ZINC687574

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Available files

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