Vitas-M small molecule compound
2-(4-fluorophenyl)-5-methyl-5-(2-methylpropyl)-1,2,4-triazolidin-3-one
Catalog ID
STL482331
SMILES CC(CC1(C)NN(C(=O)N1)c1ccc(cc1)F)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 C13H18FN3O MW 251.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H18FN3O/c1-9(2)8-13(3)15-12(18)17(16-13)11-6-4-10(14)5-7-11/h4-7,9,16H,8H2,1-3H3,(H,15,18)InChIKey
TYSSYMLHCXCWBB-UHFFFAOYSA-NSynonyms
2(4fluorophenyl)5methyl5(2methylpropyl)124triazolidin3one
CC(C)CC1(NC(=O)N(N1)C2=CC=C(C=C2)F)C
InChI=1SC13H18FN3Oc19(2)813(3)1512(18)17(1613)116410(14)5711h47916H8H213H3(H1518)
MFCD30713262
ZINC000334161109
ZINC000334161110
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