Vitas-M small molecule compound
3-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-5-[(2-methylprop-2-en-1-yl)sulfanyl]-4H-1,2,4-triazole
Catalog ID
STL337875
SMILES COc1ccc(cc1)n1c(SCC(=C)C)nnc1c1ccc(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 C23H27N3OS MW 393.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N3OS/c1-16(2)15-28-22-25-24-21(17-7-9-18(10-8-17)23(3,4)5)26(22)19-11-13-20(27-6)14-12-19/h7-14H,1,15H2,2-6H3InChIKey
WKNRBBTYVUHIJG-UHFFFAOYSA-NSynonyms
613227-73-91(5(4(TERTBUTYL)PHENYL)3(2METHYLPROP2ENYLTHIO)(124TRIAZOL4YL))4METHOXYBENZENE
3(4(tertbutyl)phenyl)4(4methoxyphenyl)5((2methylallyl)thio)4H124triazole
3(4tertbutylphenyl)4(4methoxyphenyl)5((2methylprop2en1yl)sulfanyl)4H124triazole
3(4TERTBUTYLPHENYL)4(4METHOXYPHENYL)5(2METHYLPROP2ENYLSULFANYL)124TRIAZOLE
613227739
CC(=C)CSC1=NN=C(N1C2=CC=C(C=C2)OC)C3=CC=C(C=C3)C(C)(C)C
InChI=1SC23H27N3OSc116(2)152822252421(177918(10817)23(34)5)26(22)19111320(276)141219h714H115H226H3
MFCD03416969
ZINC000002232630
ZINC02232630
ZINC2232630
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