Vitas-M small molecule compound

N-benzyl-2-{(2E)-2-[3-(4-nitrophenyl)-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazinyl}benzamide

Catalog ID
STK092457
SMILES O=C1N(N=C(/C/1=N\Nc1ccccc1C(=O)NCc1ccccc1)c1ccc(cc1)[N+](=O)[O-])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 C29H22N6O4 MW 518.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H22N6O4/c36-28(30-19-20-9-3-1-4-10-20)24-13-7-8-14-25(24)31-32-27-26(21-15-17-23(18-16-21)35(38)39)33-34(29(27)37)22-11-5-2-6-12-22/h1-18,31H,19H2,(H,30,36)/b32-27+
InChIKey
OEZNLBKWPRUKAV-QVAGMWBUSA-N
Synonyms

C1=CC=C(C=C1)CNC(=O)C2=CC=CC=C2NN=C3C(=NN(C3=O)C4=CC=CC=C4)C5=CC=C(C=C5)(N+)(=O)(O)
InChI=1SC29H22N6O4c3628(30192093141020)2413781425(24)31322726(21151723(181621)35(38)39)3334(29(27)37)22115261222h11831H19H2(H3036)b3227+
MFCD01418799
NBENZYL2((2E)2(3(4NITROPHENYL)5OXO1PHENYL15DIHYDRO4HPYRAZOL4YLIDENE)HYDRAZINYL)BENZAMIDE
NBENZYL2((2E)2(3(4NITROPHENYL)5OXO1PHENYLPYRAZOL4YLIDENE)HYDRAZINYL)BENZAMIDE
O=C1N(N=C(C1=NNc1ccccc1C(=O)NCc1ccccc1)c1ccc(cc1)(N+)(=O)(O))c1ccccc1
STK092457
ZINC000095215279
ZINC08872076
ZINC8872076

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Available files

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