Vitas-M small molecule compound
5-(4-methoxybenzyl)-5-methyl-2-phenyl-1,2,4-triazolidine-3-thione
Catalog ID
STK118768
SMILES COc1ccc(cc1)CC1(C)NC(=S)N(N1)c1ccccc1
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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 C17H19N3OS MW 313.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N3OS/c1-17(12-13-8-10-15(21-2)11-9-13)18-16(22)20(19-17)14-6-4-3-5-7-14/h3-11,19H,12H2,1-2H3,(H,18,22)InChIKey
BYRPABIHYGGPJW-UHFFFAOYSA-NSynonyms
5((4methoxyphenyl)methyl)5methyl2phenyl124triazolidine3thione
5(4METHOXYBENZYL)5METHYL2PHENYL124TRIAZOLIDINE3THIONE
CC1(NC(=S)N(N1)C2=CC=CC=C2)CC3=CC=C(C=C3)OC
InChI=1SC17H19N3OSc117(121381015(212)11913)1816(22)20(1917)146435714h31119H12H212H3(H1822)
MFCD30704384
ZINC000027906465
ZINC000027906470
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