Vitas-M small molecule compound
methyl [(4Z)-4-(1-{[2-(4-chlorophenyl)ethyl]amino}ethylidene)-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-3-yl]acetate
Catalog ID
STK262006
SMILES COC(=O)CC1=NN(C(=O)/C/1=C(\NCCc1ccc(cc1)Cl)/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 C22H22ClN3O3 MW 411.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClN3O3/c1-15(24-13-12-16-8-10-17(23)11-9-16)21-19(14-20(27)29-2)25-26(22(21)28)18-6-4-3-5-7-18/h3-11,24H,12-14H2,1-2H3/b21-15-InChIKey
XGLZFKMXJBXWMK-QNGOZBTKSA-NSynonyms
(Z)methyl2(4(1((4chlorophenethyl)amino)ethylidene)5oxo1phenyl45dihydro1Hpyrazol3yl)acetate
CC(=C1C(=NN(C1=O)C2=CC=CC=C2)CC(=O)OC)NCCC3=CC=C(C=C3)Cl
COC(=O)CC1=NN(C(=O)C1=C(NCCc1ccc(cc1)Cl)C)c1ccccc1
InChI=1SC22H22ClN3O3c115(2413121681017(23)11916)2119(1420(27)292)2526(22(21)28)186435718h31124H1214H212H3b2115
methyl((4Z)4(1((2(4chlorophenyl)ethyl)amino)ethylidene)5oxo1phenyl45dihydro1Hpyrazol3yl)acetate
methyl2((4Z)4(1(2(4chlorophenyl)ethylamino)ethylidene)5oxo1phenylpyrazol3yl)acetate
METHYL2(4(((2(4CHLOROPHENYL)ETHYL)AMINO)ETHYLIDENE)5OXO1PHENYL12DIAZOLIN3YL)ACETATE
MFCD07597746
ZINC000009060029
ZINC09060029
ZINC9060029
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