Vitas-M small molecule compound
methyl [(4E)-4-{1-[(4-methoxyphenyl)amino]propylidene}-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-3-yl]acetate
Catalog ID
STK360744
SMILES CC/C(=C\1/C(=NN(C1=O)c1ccccc1)CC(=O)OC)/Nc1ccc(cc1)OC
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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 C22H23N3O4 MW 393.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O4/c1-4-18(23-15-10-12-17(28-2)13-11-15)21-19(14-20(26)29-3)24-25(22(21)27)16-8-6-5-7-9-16/h5-13,23H,4,14H2,1-3H3/b21-18+InChIKey
JGHMNQJURHIIEG-DYTRJAOYSA-NSynonyms
CCC(=C1C(=NN(C1=O)c1ccccc1)CC(=O)OC)Nc1ccc(cc1)OC
CCC(=C1C(=NN(C1=O)C2=CC=CC=C2)CC(=O)OC)NC3=CC=C(C=C3)OC
InChI=1SC22H23N3O4c1418(2315101217(282)131115)2119(1420(26)293)2425(22(21)27)168657916h51323H414H213H3b2118+
methyl((4E)4(1((4methoxyphenyl)amino)propylidene)5oxo1phenyl45dihydro1Hpyrazol3yl)acetate
methyl2((4E)4(1(4methoxyanilino)propylidene)5oxo1phenylpyrazol3yl)acetate
MFCD11852603
ZINC000019894231
ZINC19894231
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