Vitas-M small molecule compound

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

Catalog ID
STK089529
SMILES Cc1ccc(cc1)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 C21H18N4S MW 358.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N4S/c1-16-7-9-19(10-8-16)25-20(18-11-13-22-14-12-18)23-24-21(25)26-15-17-5-3-2-4-6-17/h2-14H,15H2,1H3
InChIKey
OPKRNMKWRPFNAK-UHFFFAOYSA-N
Synonyms
482637-19-4
4(4METHYLPHENYL)3(PHENYLMETHYLTHIO)5(4PYRIDYL)124TRIAZOLE
4(5(BENZYLSULFANYL)4(4METHYLPHENYL)4H124TRIAZOL3YL)PYRIDINE
4(5(benzylthio)4(ptolyl)4H124triazol3yl)pyridine
4(5BENZYLSULFANYL4(4METHYLPHENYL)124TRIAZOL3YL)PYRIDINE
4(5BENZYLSULFANYL4PTOLYL4H(124)TRIAZOL3YL)PYRIDINE
482637194
BENZYL4(4METHYLPHENYL)5(4PYRIDINYL)4H124TRIAZOL3YLSULFIDE
CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC=C3)C4=CC=NC=C4
Cc1ccc(cc1)n1c(SCc2ccccc2)nnc1c1ccncc1
InChI=1SC21H18N4Sc1167919(10816)2520(18111322141218)232421(25)2615175324617h214H15H21H3
MFCD02226713
STK089529
ZINC000000897307
ZINC00897307
ZINC897307

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Available files

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