Vitas-M small molecule compound

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

Catalog ID
STK587189
SMILES CCOc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)F)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 C26H25FN4O3S MW 492.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25FN4O3S/c1-3-33-22-13-9-21(10-14-22)31-24(16-34-23-11-7-18(2)8-12-23)29-30-26(31)35-17-25(32)28-20-6-4-5-19(27)15-20/h4-15H,3,16-17H2,1-2H3,(H,28,32)
InChIKey
JTLYDBSXNMHDFM-UHFFFAOYSA-N
Synonyms
896594-57-3
2((4(4ETHOXYPHENYL)5((4METHYLPHENOXY)METHYL)124TRIAZOL3YL)SULFANYL)N(3FLUOROPHENYL)ACETAMIDE
2((4(4ethoxyphenyl)5((4methylphenoxy)methyl)4H124triazol3yl)sulfanyl)N(3fluorophenyl)acetamide
2((4(4ethoxyphenyl)5((ptolyloxy)methyl)4H124triazol3yl)thio)N(3fluorophenyl)acetamide
2((4(4ETHOXYPHENYL)5(4METHYLPHENOXYMETHYL)4H124TRIAZOL3YL)SULFANYL)N(3FLUOROPHENYL)ACETAMIDE
2(4(4ETHOXYPHENYL)5((4METHYLPHENOXY)METHYL)(124TRIAZOL3YLTHIO))N(3FLUOROPHENYL)ACETAMIDE
896594573
CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC(=CC=C3)F)COC4=CC=C(C=C4)C
InChI=1SC26H25FN4O3Sc13332213921(101422)3124(16342311718(2)81223)293026(31)351725(32)282064519(27)1520h415H31617H212H3(H2832)
MFCD06594747
ZINC000002196649
ZINC02196649
ZINC2196649

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Available files

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