Vitas-M small molecule compound
4-(4-tert-butylphenyl)-5-[(4-methylphenoxy)methyl]-2-(piperidin-1-ylmethyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STL186049
SMILES Cc1ccc(cc1)OCc1nn(c(=S)n1c1ccc(cc1)C(C)(C)C)CN1CCCCC1
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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 C26H34N4OS MW 450.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H34N4OS/c1-20-8-14-23(15-9-20)31-18-24-27-29(19-28-16-6-5-7-17-28)25(32)30(24)22-12-10-21(11-13-22)26(2,3)4/h8-15H,5-7,16-19H2,1-4H3InChIKey
BMLRYGUKKAOGLH-UHFFFAOYSA-NSynonyms
4(4tertbutylphenyl)5((4methylphenoxy)methyl)2(piperidin1ylmethyl)124triazole3thione
4(4tertbutylphenyl)5((4methylphenoxy)methyl)2(piperidin1ylmethyl)24dihydro3H124triazole3thione
CC1=CC=C(C=C1)OCC2=NN(C(=S)N2C3=CC=C(C=C3)C(C)(C)C)CN4CCCCC4
InChI=1SC26H34N4OSc12081423(15920)3118242729(1928166571728)25(32)30(24)22121021(111322)26(23)4h815H571619H214H3
MFCD22387684
ZINC000072329972
ZINC72329972
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