Vitas-M small molecule compound

2-[(4-chlorobenzyl)sulfanyl]-4,6-dimethylpyrimidine

Catalog ID
STK730542
SMILES Clc1ccc(cc1)CSc1nc(C)cc(n1)C

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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 C13H13ClN2S MW 264.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13ClN2S/c1-9-7-10(2)16-13(15-9)17-8-11-3-5-12(14)6-4-11/h3-7H,8H2,1-2H3
InChIKey
KPTJWMRFPUWCMR-UHFFFAOYSA-N
Synonyms
3569-34-4
2((4chlorobenzyl)sulfanyl)46dimethylpyrimidine
2((4CHLOROPHENYL)METHYLSULFANYL)46DIMETHYLPYRIMIDINE
2((4CHLOROPHENYL)METHYLTHIO)46DIMETHYLPYRIMIDINE
2(4CHLOROBENZYLSULFANYL)46DIMETHYLPYRIMIDINE
3569344
CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)Cl)C
InChI=1SC13H13ClN2Sc19710(2)1613(159)178113512(14)6411h37H8H212H3
MFCD01579648
ZINC000000052890
ZINC00052890
ZINC52890

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Available files

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