Vitas-M small molecule compound

2-(benzylsulfanyl)-5,5-dimethyl-1,4,5,6-tetrahydropyrimidine

Catalog ID
STK383751
SMILES CC1(C)CNC(=NC1)SCc1ccccc1

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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 C13H18N2S MW 234.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H18N2S/c1-13(2)9-14-12(15-10-13)16-8-11-6-4-3-5-7-11/h3-7H,8-10H2,1-2H3,(H,14,15)
InChIKey
WFSQXDKLEKDBLT-UHFFFAOYSA-N
Synonyms

2(benzylsulfanyl)55dimethyl1456tetrahydropyrimidine
2BENZYLSULFANYL55DIMETHYL46DIHYDRO1HPYRIMIDINE
CC1(CNC(=NC1)SCC2=CC=CC=C2)C
InChI=1SC13H18N2Sc113(2)91412(151013)168116435711h37H810H212H3(H1415)
MFCD11853240
ZINC000004554245
ZINC04554245
ZINC4554245

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Available files

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