Vitas-M small molecule compound

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

Catalog ID
STL057471
SMILES Fc1ccc(cc1)CSc1nnc(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 C25H24FN3S MW 417.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24FN3S/c1-25(2,3)20-13-11-19(12-14-20)23-27-28-24(29(23)22-7-5-4-6-8-22)30-17-18-9-15-21(26)16-10-18/h4-16H,17H2,1-3H3
InChIKey
KYDWBPHVSVVCGW-UHFFFAOYSA-N
Synonyms
861116-42-9
3(4(tertbutyl)phenyl)5((4fluorobenzyl)thio)4phenyl4H124triazole
3(4tertbutylphenyl)5((4fluorobenzyl)sulfanyl)4phenyl4H124triazole
3(4TERTBUTYLPHENYL)5((4FLUOROPHENYL)METHYLSULFANYL)4PHENYL124TRIAZOLE
5(4(TERTBUTYL)PHENYL)3((4FLUOROPHENYL)METHYLTHIO)4PHENYL124TRIAZOLE
861116429
CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCC4=CC=C(C=C4)F
InChI=1SC25H24FN3Sc125(23)20131119(121420)23272824(29(23)227546822)30171891521(26)161018h416H17H213H3
MFCD04546844
ZINC000005477842
ZINC05477842
ZINC5477842

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Available files

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