Vitas-M small molecule compound
3-(4-tert-butylphenyl)-5-[(2,5-dimethylbenzyl)sulfanyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazole
Catalog ID
STK091567
SMILES COc1ccc(cc1)n1c(SCc2cc(C)ccc2C)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 C28H31N3OS MW 457.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N3OS/c1-19-7-8-20(2)22(17-19)18-33-27-30-29-26(21-9-11-23(12-10-21)28(3,4)5)31(27)24-13-15-25(32-6)16-14-24/h7-17H,18H2,1-6H3InChIKey
XNYVZZBBYNOVQL-UHFFFAOYSA-NSynonyms
499103-43-41(5(4(TERTBUTYL)PHENYL)3((25DIMETHYLPHENYL)METHYLTHIO)(124TRIAZOL4YL))4METHOXYBENZENE
3(4(tertbutyl)phenyl)5((25dimethylbenzyl)thio)4(4methoxyphenyl)4H124triazole
3(4TERTBUTYLPHENYL)5(((25DIMETHYLPHENYL)METHYL)SULFANYL)4(4METHOXYPHENYL)4H124TRIAZOLE
3(4TERTBUTYLPHENYL)5((25DIMETHYLBENZYL)SULFANYL)4(4METHOXYPHENYL)4H124TRIAZOLE
3(4TERTBUTYLPHENYL)5((25DIMETHYLPHENYL)METHYLSULFANYL)4(4METHOXYPHENYL)124TRIAZOLE
499103434
CC1=CC(=C(C=C1)C)CSC2=NN=C(N2C3=CC=C(C=C3)OC)C4=CC=C(C=C4)C(C)(C)C
COc1ccc(cc1)n1c(SCc2cc(C)ccc2C)nnc1c1ccc(cc1)C(C)(C)C
InChI=1SC28H31N3OSc1197820(2)22(1719)183327302926(2191123(121021)28(34)5)31(27)24131525(326)161424h717H18H216H3
MFCD03474127
STK091567
ZINC000001832813
ZINC01832813
ZINC1832813
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