Vitas-M small molecule compound
methyl [(4Z)-4-{1-[(4-methoxyphenyl)amino]ethylidene}-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-3-yl]acetate
Catalog ID
STK234793
SMILES COC(=O)CC1=NN(C(=O)/C/1=C(\Nc1ccc(cc1)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 C21H21N3O4 MW 379.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O4/c1-14(22-15-9-11-17(27-2)12-10-15)20-18(13-19(25)28-3)23-24(21(20)26)16-7-5-4-6-8-16/h4-12,22H,13H2,1-3H3/b20-14-InChIKey
QNKXKHJDAIGVMR-ZHZULCJRSA-NSynonyms
CC(=C1C(=NN(C1=O)C2=CC=CC=C2)CC(=O)OC)NC3=CC=C(C=C3)OC
COC(=O)CC1=NN(C(=O)C1=C(Nc1ccc(cc1)OC)C)c1ccccc1
InChI=1SC21H21N3O4c114(221591117(272)121015)2018(1319(25)283)2324(21(20)26)167546816h41222H13H213H3b2014
methyl((4Z)4(1((4methoxyphenyl)amino)ethylidene)5oxo1phenyl45dihydro1Hpyrazol3yl)acetate
METHYL2((4Z)4(1(4METHOXYANILINO)ETHYLIDENE)5OXO1PHENYLPYRAZOL3YL)ACETATE
METHYL2(4(((4METHOXYPHENYL)AMINO)ETHYLIDENE)5OXO1PHENYL12DIAZOLIN3YL)ACETATE
MFCD07598111
ZINC000004999671
ZINC04999671
ZINC4999671
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