Vitas-M small molecule compound

2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)butanamide

Catalog ID
STK243011
SMILES CCOc1ccc2c(c1)sc(n2)NC(=O)C(Sc1nc(C)cc(n1)C)CC

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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 C19H22N4O2S2 MW 402.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N4O2S2/c1-5-15(26-18-20-11(3)9-12(4)21-18)17(24)23-19-22-14-8-7-13(25-6-2)10-16(14)27-19/h7-10,15H,5-6H2,1-4H3,(H,22,23,24)
InChIKey
RALUDWTYGWKKRB-UHFFFAOYSA-N
Synonyms

2((46DIMETHYLPYRIMIDIN2YL)SULFANYL)N(6ETHOXY13BENZOTHIAZOL2YL)BUTANAMIDE
2(46DIMETHYLPYRIMIDIN2YL)SULFANYLN(6ETHOXY13BENZOTHIAZOL2YL)BUTANAMIDE
CCC(C(=O)NC1=NC2=C(S1)C=C(C=C2)OCC)SC3=NC(=CC(=N3)C)C
InChI=1SC19H22N4O2S2c1515(26182011(3)912(4)2118)17(24)231922148713(2562)1016(14)2719h71015H56H214H3(H222324)
MFCD08673355
ZINC000008195722
ZINC000008197434

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Available files

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