Vitas-M small molecule compound
methyl [(4Z)-4-{1-[(3-methoxypropyl)amino]ethylidene}-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-3-yl]acetate
Catalog ID
STK231976
SMILES COCCCN/C(=C\1/C(=NN(C1=O)c1ccccc1)CC(=O)OC)/C
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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 C18H23N3O4 MW 345.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23N3O4/c1-13(19-10-7-11-24-2)17-15(12-16(22)25-3)20-21(18(17)23)14-8-5-4-6-9-14/h4-6,8-9,19H,7,10-12H2,1-3H3/b17-13-InChIKey
XFSPMQBEOHVPPJ-LGMDPLHJSA-NSynonyms
CC(=C1C(=NN(C1=O)C2=CC=CC=C2)CC(=O)OC)NCCCOC
COCCCNC(=C1C(=NN(C1=O)c1ccccc1)CC(=O)OC)C
InChI=1SC18H23N3O4c113(1910711242)1715(1216(22)253)2021(18(17)23)148546914h468919H71012H213H3b1713
methyl((4Z)4(1((3methoxypropyl)amino)ethylidene)5oxo1phenyl45dihydro1Hpyrazol3yl)acetate
METHYL2((4Z)4(1(3METHOXYPROPYLAMINO)ETHYLIDENE)5OXO1PHENYLPYRAZOL3YL)ACETATE
METHYL2(4(((3METHOXYPROPYL)AMINO)ETHYLIDENE)5OXO1PHENYL12DIAZOLIN3YL)ACETATE
MFCD07597901
ZINC000004736917
ZINC04736917
ZINC4736917
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