Vitas-M small molecule compound
(4E)-2-(3,4-dimethylphenyl)-5-methyl-4-(morpholin-4-ylmethylidene)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL295105
SMILES CC1=NN(C(=O)/C/1=C/N1CCOCC1)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 C17H21N3O2 MW 299.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N3O2/c1-12-4-5-15(10-13(12)2)20-17(21)16(14(3)18-20)11-19-6-8-22-9-7-19/h4-5,10-11H,6-9H2,1-3H3/b16-11+InChIKey
NGWGHRWTFHYGSY-LFIBNONCSA-NSynonyms
(4E)2(34dimethylphenyl)5methyl4(morpholin4ylmethylidene)24dihydro3Hpyrazol3one
(4E)2(34DIMETHYLPHENYL)5METHYL4(MORPHOLIN4YLMETHYLIDENE)PYRAZOL3ONE
CC1=C(C=C(C=C1)N2C(=O)C(=CN3CCOCC3)C(=N2)C)C
CC1=NN(C(=O)C1=CN1CCOCC1)c1ccc(c(c1)C)C
InChI=1SC17H21N3O2c1124515(1013(12)2)2017(21)16(14(3)1820)111968229719h451011H69H213H3b1611+
MFCD00740483
ZINC000032109903
ZINC32109903
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