Vitas-M small molecule compound

(5E)-5-({[3-(diethylamino)propyl]amino}methylidene)-1-[2-(3,4-dimethoxyphenyl)ethyl]-2-sulfanylpyrimidine-4,6(1H,5H)-dione

Catalog ID
STK566358
SMILES CCN(CCCN/C=C/1\C(=O)N=C(N(C1=O)CCc1ccc(c(c1)OC)OC)S)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 C22H32N4O4S MW 448.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H32N4O4S/c1-5-25(6-2)12-7-11-23-15-17-20(27)24-22(31)26(21(17)28)13-10-16-8-9-18(29-3)19(14-16)30-4/h8-9,14-15,23H,5-7,10-13H2,1-4H3,(H,24,27,31)/b17-15+
InChIKey
NYDJRNLTOOBFQW-BMRADRMJSA-N
Synonyms

CCN(CCCNC=C1C(=O)N=C(N(C1=O)CCc1ccc(c(c1)OC)OC)S)CC
MFCD04081074
ZINC000020442383

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Available files

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