Vitas-M small molecule compound

(5E)-1-(2-chlorophenyl)-5-({[4-(diethylamino)phenyl]amino}methylidene)-2-sulfanylpyrimidine-4,6(1H,5H)-dione

Catalog ID
STL037104
SMILES CCN(c1ccc(cc1)N/C=C/1\C(=O)N=C(N(C1=O)c1ccccc1Cl)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 C21H21ClN4O2S MW 428.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClN4O2S/c1-3-25(4-2)15-11-9-14(10-12-15)23-13-16-19(27)24-21(29)26(20(16)28)18-8-6-5-7-17(18)22/h5-13,23H,3-4H2,1-2H3,(H,24,27,29)/b16-13+
InChIKey
WXUUYLQOKYRHRL-DTQAZKPQSA-N
Synonyms

CCN(c1ccc(cc1)NC=C1C(=O)N=C(N(C1=O)c1ccccc1Cl)S)CC
MFCD03816124
ZINC000009076621
ZINC000103089365

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Available files

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