Vitas-M small molecule compound

2-{[N-(3-fluorophenyl)-N-(methylsulfonyl)glycyl]amino}-N-(pyridin-3-ylmethyl)benzamide

Catalog ID
STK246655
SMILES O=C(CN(S(=O)(=O)C)c1cccc(c1)F)Nc1ccccc1C(=O)NCc1cccnc1

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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 C22H21FN4O4S MW 456.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21FN4O4S/c1-32(30,31)27(18-8-4-7-17(23)12-18)15-21(28)26-20-10-3-2-9-19(20)22(29)25-14-16-6-5-11-24-13-16/h2-13H,14-15H2,1H3,(H,25,29)(H,26,28)
InChIKey
WWOBNZIWUWDIEP-UHFFFAOYSA-N
Synonyms

2((2(3fluoroNmethylsulfonylanilino)acetyl)amino)N(pyridin3ylmethyl)benzamide
2((N(3FLUOROPHENYL)N(METHYLSULFONYL)GLYCYL)AMINO)N(PYRIDIN3YLMETHYL)BENZAMIDE
CS(=O)(=O)N(CC(=O)NC1=CC=CC=C1C(=O)NCC2=CN=CC=C2)C3=CC(=CC=C3)F
InChI=1SC22H21FN4O4Sc132(3031)27(1884717(23)1218)1521(28)26201032919(20)22(29)2514166511241316h213H1415H21H3(H2529)(H2628)
MFCD08672410
ZINC000009667731
ZINC09667731
ZINC9667731

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Available files

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