Vitas-M small molecule compound
methyl (2E)-3-(dimethylamino)-2-{(4Z)-4-[(dimethylamino)methylidene]-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-3-yl}prop-2-enoate
Catalog ID
STL197582
SMILES COC(=O)/C(=C/N(C)C)/C1=NN(C(=O)/C/1=C\N(C)C)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 C18H22N4O3 MW 342.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N4O3/c1-20(2)11-14-16(15(12-21(3)4)18(24)25-5)19-22(17(14)23)13-9-7-6-8-10-13/h6-12H,1-5H3/b14-11-,15-12+InChIKey
LZFSEKQTFSZXIA-KMUHKHSISA-NSynonyms
1152430-03-9(Z)methyl3(dimethylamino)2((Z)4((dimethylamino)methylene)5oxo1phenyl45dihydro1Hpyrazol3yl)acrylate
1152430039
CN(C)C=C1C(=NN(C1=O)C2=CC=CC=C2)C(=CN(C)C)C(=O)OC
COC(=O)C(=CN(C)C)C1=NN(C(=O)C1=CN(C)C)c1ccccc1
InChI=1SC18H22N4O3c120(2)111416(15(1221(3)4)18(24)255)1922(17(14)23)1397681013h612H15H3b14111512+
METHYL(2E)3(DIMETHYLAMINO)2((4Z)4((DIMETHYLAMINO)METHYLENE)5OXO1PHENYL45DIHYDRO1HPYRAZOL3YL)ACRYLATE
methyl(2E)3(dimethylamino)2((4Z)4((dimethylamino)methylidene)5oxo1phenyl45dihydro1Hpyrazol3yl)prop2enoate
methyl(E)3(dimethylamino)2((4Z)4(dimethylaminomethylidene)5oxo1phenylpyrazol3yl)prop2enoate
MFCD13969179
ZINC000030822961
ZINC30822961
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