Vitas-M small molecule compound

(4Z)-5-methyl-2-(4-nitrophenyl)-4-{1-[(2-phenylethyl)amino]ethylidene}-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STK261644
SMILES C/C(=C/1\C(=NN(C1=O)c1ccc(cc1)[N+](=O)[O-])C)/NCCc1ccccc1

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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 C20H20N4O3 MW 364.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O3/c1-14(21-13-12-16-6-4-3-5-7-16)19-15(2)22-23(20(19)25)17-8-10-18(11-9-17)24(26)27/h3-11,21H,12-13H2,1-2H3/b19-14-
InChIKey
OEXKHOIRPXDYRX-RGEXLXHISA-N
Synonyms

(4Z)5METHYL2(4NITROPHENYL)4(1((2PHENYLETHYL)AMINO)ETHYLIDENE)24DIHYDRO3HPYRAZOL3ONE
(4Z)5methyl2(4nitrophenyl)4(1(2phenylethylamino)ethylidene)pyrazol3one
(4Z)5METHYL2(4NITROPHENYL)4(1(PHENETHYLAMINO)ETHYLIDENE)PYRAZOL3ONE
3METHYL1(4NITROPHENYL)4(((2PHENYLETHYL)AMINO)ETHYLIDENE)12DIAZOLIN5ONE
CC(=C1C(=NN(C1=O)c1ccc(cc1)(N+)(=O)(O))C)NCCc1ccccc1
CC1=NN(C(=O)C1=C(C)NCCC2=CC=CC=C2)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC20H20N4O3c114(211312166435716)1915(2)2223(20(19)25)1781018(11917)24(26)27h31121H1213H212H3b1914
MFCD02300151
ZINC000100095484
ZINC100095484

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Available files

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