Vitas-M small molecule compound

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

Catalog ID
STK401040
SMILES O=C(Nc1ccc(c(c1)Cl)F)CSc1nnc(n1C)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 C16H13ClFN5OS MW 377.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13ClFN5OS/c1-23-15(10-3-2-6-19-8-10)21-22-16(23)25-9-14(24)20-11-4-5-13(18)12(17)7-11/h2-8H,9H2,1H3,(H,20,24)
InChIKey
VTFWIZDOAUHWDA-UHFFFAOYSA-N
Synonyms
752985-86-7
752985867
CN1C(=NN=C1SCC(=O)NC2=CC(=C(C=C2)F)Cl)C3=CN=CC=C3
InChI=1SC16H13ClFN5OSc12315(1032619810)212216(23)25914(24)20114513(18)12(17)711h28H9H21H3(H2024)
MFCD04016735
N(3chloro4fluorophenyl)2((4methyl5(pyridin3yl)4H124triazol3yl)sulfanyl)acetamide
N(3chloro4fluorophenyl)2((4methyl5(pyridin3yl)4H124triazol3yl)thio)acetamide
N(3CHLORO4FLUOROPHENYL)2((4METHYL5PYRIDIN3YL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(3CHLORO4FLUOROPHENYL)2((4METHYL5PYRIDIN3YL4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(3CHLORO4FLUOROPHENYL)2(4METHYL5(3PYRIDYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000005047084
ZINC05047084
ZINC5047084

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Available files

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