Vitas-M small molecule compound
methyl [(4Z)-4-{1-[(3-methoxybenzyl)amino]ethylidene}-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-3-yl]acetate
Catalog ID
STK231960
SMILES COC(=O)CC1=NN(C(=O)/C/1=C(\NCc1cccc(c1)OC)/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(23-14-16-8-7-11-18(12-16)28-2)21-19(13-20(26)29-3)24-25(22(21)27)17-9-5-4-6-10-17/h4-12,23H,13-14H2,1-3H3/b21-15-InChIKey
RSBDQEWOTDDUEQ-QNGOZBTKSA-NSynonyms
(Z)methyl2(4(1((3methoxybenzyl)amino)ethylidene)5oxo1phenyl45dihydro1Hpyrazol3yl)acetate
CC(=C1C(=NN(C1=O)C2=CC=CC=C2)CC(=O)OC)NCC3=CC(=CC=C3)OC
COC(=O)CC1=NN(C(=O)C1=C(NCc1cccc(c1)OC)C)c1ccccc1
InChI=1SC22H23N3O4c115(231416871118(1216)282)2119(1320(26)293)2425(22(21)27)1795461017h41223H1314H213H3b2115
methyl((4Z)4(1((3methoxybenzyl)amino)ethylidene)5oxo1phenyl45dihydro1Hpyrazol3yl)acetate
METHYL2((4Z)4(1((3METHOXYPHENYL)METHYLAMINO)ETHYLIDENE)5OXO1PHENYLPYRAZOL3YL)ACETATE
METHYL2(4((((3METHOXYPHENYL)METHYL)AMINO)ETHYLIDENE)5OXO1PHENYL12DIAZOLIN3YL)ACETATE
MFCD07597633
ZINC000004736901
ZINC04736901
ZINC4736901
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