Vitas-M small molecule compound
2-{[4-cyclohexyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
Catalog ID
STK094352
SMILES O=C(Nc1ccc(cc1)F)CSc1nnc(n1C1CCCCC1)c1cccnc1
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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 C21H22FN5OS MW 411.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22FN5OS/c22-16-8-10-17(11-9-16)24-19(28)14-29-21-26-25-20(15-5-4-12-23-13-15)27(21)18-6-2-1-3-7-18/h4-5,8-13,18H,1-3,6-7,14H2,(H,24,28)InChIKey
MMHOKKJKDMWOFX-UHFFFAOYSA-NSynonyms
525582-88-12((4CYCLOHEXYL5(3PYRIDINYL)4H124TRIAZOL3YL)SULFANYL)N(4FLUOROPHENYL)ACETAMIDE
2((4CYCLOHEXYL5(PYRIDIN3YL)4H124TRIAZOL3YL)SULFANYL)N(4FLUOROPHENYL)ACETAMIDE
2((4cyclohexyl5(pyridin3yl)4H124triazol3yl)thio)N(4fluorophenyl)acetamide
2((4CYCLOHEXYL5PYRIDIN3YL124TRIAZOL3YL)SULFANYL)N(4FLUOROPHENYL)ACETAMIDE
2(4CYCLOHEXYL5(3PYRIDYL)(124TRIAZOL3YLTHIO))N(4FLUOROPHENYL)ACETAMIDE
525582881
C1CCC(CC1)N2C(=NN=C2SCC(=O)NC3=CC=C(C=C3)F)C4=CN=CC=C4
InChI=1SC21H22FN5OSc221681017(11916)2419(28)142921262520(155412231315)27(21)186213718h4581318H136714H2(H2428)
MFCD03194941
O=C(Nc1ccc(cc1)F)CSc1nnc(n1C1CCCCC1)c1cccnc1
STK094352
ZINC000000986262
ZINC00986262
ZINC986262
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.