Vitas-M small molecule compound

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

Catalog ID
STK582264
SMILES CCOc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)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 C26H24ClN3O3S MW 494.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24ClN3O3S/c1-3-32-22-14-10-21(11-15-22)30-25(16-33-23-12-4-18(2)5-13-23)28-29-26(30)34-17-24(31)19-6-8-20(27)9-7-19/h4-15H,3,16-17H2,1-2H3
InChIKey
GYABZYRMVUPROJ-UHFFFAOYSA-N
Synonyms
899390-86-4
1(4CHLOROPHENYL)2((4(4ETHOXYPHENYL)5((4METHYLPHENOXY)METHYL)124TRIAZOL3YL)SULFANYL)ETHANONE
1(4chlorophenyl)2((4(4ethoxyphenyl)5((4methylphenoxy)methyl)4H124triazol3yl)sulfanyl)ethanone
1(4chlorophenyl)2((4(4ethoxyphenyl)5((ptolyloxy)methyl)4H124triazol3yl)thio)ethanone
1(4CHLOROPHENYL)2((4(4ETHOXYPHENYL)5(4METHYLPHENOXYMETHYL)4H124TRIAZOL3YL)SULFANYL)ETHAN1ONE
1(4CHLOROPHENYL)2(4(4ETHOXYPHENYL)5((4METHYLPHENOXY)METHYL)(124TRIAZOL3YLTHIO))ETHAN1ONE
899390864
CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)C3=CC=C(C=C3)Cl)COC4=CC=C(C=C4)C
InChI=1SC26H24ClN3O3Sc133222141021(111522)3025(16332312418(2)51323)282926(30)341724(31)196820(27)9719h415H31617H212H3
MFCD06604857
ZINC000002242166
ZINC02242166
ZINC2242166

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Available files

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