Vitas-M small molecule compound

ethyl 4-{[4-(pyrimidin-2-ylsulfamoyl)phenyl]carbamothioyl}piperazine-1-carboxylate

Catalog ID
STK441205
SMILES CCOC(=O)N1CCN(CC1)C(=S)Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1

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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 C18H22N6O4S2 MW 450.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N6O4S2/c1-2-28-18(25)24-12-10-23(11-13-24)17(29)21-14-4-6-15(7-5-14)30(26,27)22-16-19-8-3-9-20-16/h3-9H,2,10-13H2,1H3,(H,21,29)(H,19,20,22)
InChIKey
BACPYDMXCYNRLN-UHFFFAOYSA-N
Synonyms

CCOC(=O)N1CCN(CC1)C(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3
ETHYL4(((4((PYRIMIDIN2YLAMINO)SULFONYL)PHENYL)AMINO)THIOXOMETHYL)PIPERAZINECARBOXYLATE
ethyl4((4(pyrimidin2ylsulfamoyl)phenyl)carbamothioyl)piperazine1carboxylate
InChI=1SC18H22N6O4S2c122818(25)24121023(111324)17(29)21144615(7514)30(2627)2216198392016h39H21013H21H3(H2129)(H192022)
MFCD03946351
ZINC000005940418
ZINC05940418
ZINC5940418

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Available files

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