Vitas-M small molecule compound
2-(3,4-dimethylphenyl)-5,5-dipropyl-1,2,4-triazolidin-3-one
Catalog ID
STL482365
SMILES CCCC1(CCC)NC(=O)N(N1)c1ccc(c(c1)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 C16H25N3O MW 275.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H25N3O/c1-5-9-16(10-6-2)17-15(20)19(18-16)14-8-7-12(3)13(4)11-14/h7-8,11,18H,5-6,9-10H2,1-4H3,(H,17,20)InChIKey
USJUVKRNIGJWGH-UHFFFAOYSA-NSynonyms
2(34dimethylphenyl)55dipropyl124triazolidin3one
CCCC1(NC(=O)N(N1)C2=CC(=C(C=C2)C)C)CCC
InChI=1SC16H25N3Oc15916(1062)1715(20)19(1816)148712(3)13(4)1114h781118H56910H214H3(H1720)
MFCD15079880
ZINC000015867880
ZINC15867880
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