Vitas-M small molecule compound

(5E)-6-hydroxy-5-[({2-[(4-methylquinolin-2-yl)amino]ethyl}amino)methylidene]-2-sulfanylpyrimidin-4(5H)-one

Catalog ID
STK610431
SMILES SC1=NC(=O)/C(=C/NCCNc2cc(C)c3c(n2)cccc3)/C(=N1)O

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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 C17H17N5O2S MW 355.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N5O2S/c1-10-8-14(20-13-5-3-2-4-11(10)13)19-7-6-18-9-12-15(23)21-17(25)22-16(12)24/h2-5,8-9,18H,6-7H2,1H3,(H,19,20)(H2,21,22,23,24,25)
InChIKey
PCSFJICFWKLMOT-UHFFFAOYSA-N
Synonyms

MFCD08734235
SC1=NC(=O)C(=CNCCNc2cc(C)c3c(n2)cccc3)C(=N1)O
ZINC000098170477

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Available files

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