Vitas-M small molecule compound
2-(3,4-dimethylphenyl)-5-methyl-4-[(propylamino)methylidene]-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK752060
SMILES CCCN/C=C/1\C(=NN(C1=O)c1ccc(c(c1)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 C16H21N3O MW 271.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21N3O/c1-5-8-17-10-15-13(4)18-19(16(15)20)14-7-6-11(2)12(3)9-14/h6-7,9-10,17H,5,8H2,1-4H3/b15-10+InChIKey
LXZSANICQOHKLF-XNTDXEJSSA-NSynonyms
(4E)2(34DIMETHYLPHENYL)5METHYL4(PROPYLAMINOMETHYLIDENE)PYRAZOL3ONE
2(34dimethylphenyl)5methyl4((propylamino)methylidene)24dihydro3Hpyrazol3one
CCCNC=C1C(=NN(C1=O)c1ccc(c(c1)C)C)C
CCCNC=C1C(=NN(C1=O)C2=CC(=C(C=C2)C)C)C
InChI=1SC16H21N3Oc15817101513(4)1819(16(15)20)147611(2)12(3)914h6791017H58H214H3b1510+
MFCD00819177
ZINC000006777882
ZINC06777882
ZINC6777882
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