Vitas-M small molecule compound

3-(4-tert-butylphenyl)-5-[(2-chlorobenzyl)sulfanyl]-4-phenyl-4H-1,2,4-triazole

Catalog ID
STK735641
SMILES Clc1ccccc1CSc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)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 C25H24ClN3S MW 434.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24ClN3S/c1-25(2,3)20-15-13-18(14-16-20)23-27-28-24(29(23)21-10-5-4-6-11-21)30-17-19-9-7-8-12-22(19)26/h4-16H,17H2,1-3H3
InChIKey
YIIMSBPIZSKDET-UHFFFAOYSA-N
Synonyms
348592-88-1
3(4(tertbutyl)phenyl)5((2chlorobenzyl)thio)4phenyl4H124triazole
3(4TERTBUTYLPHENYL)5(((2CHLOROPHENYL)METHYL)SULFANYL)4PHENYL4H124TRIAZOLE
3(4tertbutylphenyl)5((2chlorobenzyl)sulfanyl)4phenyl4H124triazole
3(4TERTBUTYLPHENYL)5((2CHLOROPHENYL)METHYLSULFANYL)4PHENYL124TRIAZOLE
348592881
CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCC4=CC=CC=C4Cl
InChI=1SC25H24ClN3Sc125(23)20151318(141620)23272824(29(23)21105461121)3017199781222(19)26h416H17H213H3
MFCD01204098
ZINC000002206336
ZINC02206336
ZINC2206336

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Available files

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