Vitas-M small molecule compound

4-[5-(benzylsulfanyl)-4-(3,4-dimethylphenyl)-4H-1,2,4-triazol-3-yl]pyridine

Catalog ID
STK112201
SMILES Cc1cc(ccc1C)n1c(SCc2ccccc2)nnc1c1ccncc1

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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 C22H20N4S MW 372.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4S/c1-16-8-9-20(14-17(16)2)26-21(19-10-12-23-13-11-19)24-25-22(26)27-15-18-6-4-3-5-7-18/h3-14H,15H2,1-2H3
InChIKey
RJVUQMYSVKHPGT-UHFFFAOYSA-N
Synonyms

4(5(BENZYLSULFANYL)4(34DIMETHYLPHENYL)4H124TRIAZOL3YL)PYRIDINE
4(5BENZYLSULFANYL4(34DIMETHYLPHENYL)124TRIAZOL3YL)PYRIDINE
CC1=C(C=C(C=C1)N2C(=NN=C2SCC3=CC=CC=C3)C4=CC=NC=C4)C
InChI=1SC22H20N4Sc1168920(1417(16)2)2621(19101223131119)242522(26)2715186435718h314H15H212H3
MFCD04127115
ZINC000006276108
ZINC06276108
ZINC6276108

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Available files

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