Vitas-M small molecule compound
3-(4-tert-butylphenyl)-5-[(4-methylbenzyl)sulfanyl]-4-(4-methylphenyl)-4H-1,2,4-triazole
Catalog ID
STK584756
SMILES Cc1ccc(cc1)n1c(nnc1c1ccc(cc1)C(C)(C)C)SCc1ccc(cc1)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 C27H29N3S MW 427.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3S/c1-19-6-10-21(11-7-19)18-31-26-29-28-25(30(26)24-16-8-20(2)9-17-24)22-12-14-23(15-13-22)27(3,4)5/h6-17H,18H2,1-5H3InChIKey
UVRXHUHWEQZPNT-UHFFFAOYSA-NSynonyms
862106-32-93(4(tertbutyl)phenyl)5((4methylbenzyl)thio)4(ptolyl)4H124triazole
3(4TERTBUTYLPHENYL)4(4METHYLPHENYL)5((4METHYLPHENYL)METHYLSULFANYL)124TRIAZOLE
3(4tertbutylphenyl)5((4methylbenzyl)sulfanyl)4(4methylphenyl)4H124triazole
5(4(TERTBUTYL)PHENYL)4(4METHYLPHENYL)3((4METHYLPHENYL)METHYLTHIO)124TRIAZOLE
862106329
CC1=CC=C(C=C1)CSC2=NN=C(N2C3=CC=C(C=C3)C)C4=CC=C(C=C4)C(C)(C)C
InChI=1SC27H29N3Sc11961021(11719)183126292825(30(26)2416820(2)91724)22121423(151322)27(34)5h617H18H215H3
MFCD05686869
ZINC000005484935
ZINC05484935
ZINC5484935
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