Vitas-M small molecule compound

methyl [(4Z)-4-(1-{[2-(4-hydroxyphenyl)ethyl]amino}ethylidene)-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-3-yl]acetate

Catalog ID
STK231979
SMILES COC(=O)CC1=NN(C(=O)/C/1=C(\NCCc1ccc(cc1)O)/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 C22H23N3O4 MW 393.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O4/c1-15(23-13-12-16-8-10-18(26)11-9-16)21-19(14-20(27)29-2)24-25(22(21)28)17-6-4-3-5-7-17/h3-11,23,26H,12-14H2,1-2H3/b21-15-
InChIKey
FOWOTNKLQGRVHC-QNGOZBTKSA-N
Synonyms

(Z)methyl2(4(1((4hydroxyphenethyl)amino)ethylidene)5oxo1phenyl45dihydro1Hpyrazol3yl)acetate
CC(=C1C(=NN(C1=O)C2=CC=CC=C2)CC(=O)OC)NCCC3=CC=C(C=C3)O
COC(=O)CC1=NN(C(=O)C1=C(NCCc1ccc(cc1)O)C)c1ccccc1
InChI=1SC22H23N3O4c115(2313121681018(26)11916)2119(1420(27)292)2425(22(21)28)176435717h3112326H1214H212H3b2115
methyl((4Z)4(1((2(4hydroxyphenyl)ethyl)amino)ethylidene)5oxo1phenyl45dihydro1Hpyrazol3yl)acetate
METHYL2((4Z)4(1(2(4HYDROXYPHENYL)ETHYLAMINO)ETHYLIDENE)5OXO1PHENYLPYRAZOL3YL)ACETATE
METHYL2(4(((2(4HYDROXYPHENYL)ETHYL)AMINO)ETHYLIDENE)5OXO1PHENYL12DIAZOLIN3YL)ACETATE
MFCD07597916
ZINC000004736920
ZINC04736920
ZINC4736920

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Available files

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