Vitas-M small molecule compound
(4Z)-4-({[2-(4-methoxyphenyl)ethyl]amino}methylidene)-5-methyl-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK097321
SMILES COc1ccc(cc1)CCN/C=C\1/C(=NN(C1=O)c1ccc(cc1)[N+](=O)[O-])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 C20H20N4O4 MW 380.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O4/c1-14-19(13-21-12-11-15-3-9-18(28-2)10-4-15)20(25)23(22-14)16-5-7-17(8-6-16)24(26)27/h3-10,13,21H,11-12H2,1-2H3/b19-13-InChIKey
ALMDQOGCHGBVAM-UYRXBGFRSA-NSynonyms
(4Z)4(((2(4METHOXYPHENYL)ETHYL)AMINO)METHYLIDENE)5METHYL2(4NITROPHENYL)24DIHYDRO3HPYRAZOL3ONE
(4Z)4((2(4METHOXYPHENYL)ETHYLAMINO)METHYLIDENE)5METHYL2(4NITROPHENYL)PYRAZOL3ONE
CC1=NN(C(=O)C1=CNCCC2=CC=C(C=C2)OC)C3=CC=C(C=C3)(N+)(=O)(O)
COc1ccc(cc1)CCNC=C1C(=NN(C1=O)c1ccc(cc1)(N+)(=O)(O))C
InChI=1SC20H20N4O4c11419(13211211153918(282)10415)20(25)23(2214)165717(8616)24(26)27h3101321H1112H212H3b1913
MFCD03033640
STK097321
ZINC000004663960
ZINC04663960
ZINC4663960
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