Vitas-M small molecule compound

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

Catalog ID
STK497670
SMILES O=C(C(Sc1nnc(n1C)c1cccnc1)C)Nc1ccc(cc1F)F

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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 C17H15F2N5OS MW 375.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15F2N5OS/c1-10(16(25)21-14-6-5-12(18)8-13(14)19)26-17-23-22-15(24(17)2)11-4-3-7-20-9-11/h3-10H,1-2H3,(H,21,25)
InChIKey
XEDUUEZQNSZTDS-UHFFFAOYSA-N
Synonyms

CC(C(=O)NC1=C(C=C(C=C1)F)F)SC2=NN=C(N2C)C3=CN=CC=C3
InChI=1SC17H15F2N5OSc110(16(25)21146512(18)813(14)19)2617232215(24(17)2)1143720911h310H12H3(H2125)
MFCD11855033
N(24difluorophenyl)2((4methyl5(pyridin3yl)4H124triazol3yl)sulfanyl)propanamide
N(24difluorophenyl)2((4methyl5pyridin3yl124triazol3yl)sulfanyl)propanamide
ZINC000016727328
ZINC000016727330

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Available files

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