Vitas-M small molecule compound

4-[({[(3-cyano-6-methylpyridin-2-yl)sulfanyl]acetyl}amino)methyl]benzoic acid

Catalog ID
STK922090
SMILES N#Cc1ccc(nc1SCC(=O)NCc1ccc(cc1)C(=O)O)C

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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 C17H15N3O3S MW 341.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15N3O3S/c1-11-2-5-14(8-18)16(20-11)24-10-15(21)19-9-12-3-6-13(7-4-12)17(22)23/h2-7H,9-10H2,1H3,(H,19,21)(H,22,23)
InChIKey
MPNDVFXJKMZSFN-UHFFFAOYSA-N
Synonyms

4(((((3cyano6methylpyridin2yl)sulfanyl)acetyl)amino)methyl)benzoicacid
4(((2(3CYANO6METHYLPYRIDIN2YL)SULFANYLACETYL)AMINO)METHYL)BENZOICACID
4((2(3CYANO6METHYL2PYRIDYLTHIO)ACETYLAMINO)METHYL)BENZOICACID
CC1=NC(=C(C=C1)C#N)SCC(=O)NCC2=CC=C(C=C2)C(=O)O
InChI=1SC17H15N3O3Sc1112514(818)16(2011)241015(21)199123613(7412)17(22)23h27H910H21H3(H1921)(H2223)
MFCD03546612
ZINC000004193598
ZINC4193598

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Available files

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