Vitas-M small molecule compound

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

Catalog ID
STK574144
SMILES Cc1ccc(cc1)n1c(nnc1c1ccc(cc1)C(C)(C)C)SCc1ccc(cc1)F

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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 C26H26FN3S MW 431.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26FN3S/c1-18-5-15-23(16-6-18)30-24(20-9-11-21(12-10-20)26(2,3)4)28-29-25(30)31-17-19-7-13-22(27)14-8-19/h5-16H,17H2,1-4H3
InChIKey
KTPIYDMOYXKXMH-UHFFFAOYSA-N
Synonyms
848996-03-2
3(4(tertbutyl)phenyl)5((4fluorobenzyl)thio)4(ptolyl)4H124triazole
3(4TERTBUTYLPHENYL)5(((4FLUOROPHENYL)METHYL)SULFANYL)4(4METHYLPHENYL)4H124TRIAZOLE
3(4tertbutylphenyl)5((4fluorobenzyl)sulfanyl)4(4methylphenyl)4H124triazole
3(4TERTBUTYLPHENYL)5((4FLUOROPHENYL)METHYLSULFANYL)4(4METHYLPHENYL)124TRIAZOLE
5(4(TERTBUTYL)PHENYL)3((4FLUOROPHENYL)METHYLTHIO)4(4METHYLPHENYL)124TRIAZOLE
848996032
CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)F)C4=CC=C(C=C4)C(C)(C)C
InChI=1SC26H26FN3Sc11851523(16618)3024(2091121(121020)26(23)4)282925(30)31171971322(27)14819h516H17H214H3
MFCD05679474
ZINC000002447633
ZINC02447633
ZINC2447633

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Available files

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