Vitas-M small molecule compound

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

Catalog ID
STK063050
SMILES COc1ccc(cc1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)Nc1ccccc1F

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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 C23H18ClFN4O2S MW 468.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18ClFN4O2S/c1-31-18-12-6-15(7-13-18)22-27-28-23(29(22)17-10-8-16(24)9-11-17)32-14-21(30)26-20-5-3-2-4-19(20)25/h2-13H,14H2,1H3,(H,26,30)
InChIKey
WUKZWAPVNHJRBJ-UHFFFAOYSA-N
Synonyms
499101-31-4
2((4(4CHLOROPHENYL)5(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)N(2FLUOROPHENYL)ACETAMIDE
2((4(4CHLOROPHENYL)5(4METHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)N(2FLUOROPHENYL)ACETAMIDE
2((4(4chlorophenyl)5(4methoxyphenyl)4H124triazol3yl)thio)N(2fluorophenyl)acetamide
2(4(4CHLOROPHENYL)5(4METHOXYPHENYL)(124TRIAZOL3YLTHIO))N(2FLUOROPHENYL)ACETAMIDE
499101314
COC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC(=O)NC4=CC=CC=C4F
COc1ccc(cc1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)Nc1ccccc1F
InChI=1SC23H18ClFN4O2Sc1311812615(71318)22272823(29(22)1710816(24)91117)321421(30)2620532419(20)25h213H14H21H3(H2630)
MFCD03223216
STK063050
ZINC000000633456
ZINC00633456
ZINC633456

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Available files

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