Vitas-M small molecule compound

3-{[(E)-(3-nitrophenyl)methylidene]amino}-2-(phenoxymethyl)quinazolin-4(3H)-one

Catalog ID
STL000088
SMILES [O-][N+](=O)c1cccc(c1)/C=N/n1c(COc2ccccc2)nc2c(c1=O)cccc2

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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 C22H16N4O4 MW 400.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16N4O4/c27-22-19-11-4-5-12-20(19)24-21(15-30-18-9-2-1-3-10-18)25(22)23-14-16-7-6-8-17(13-16)26(28)29/h1-14H,15H2/b23-14+
InChIKey
MMOLXPKPKULZLN-OEAKJJBVSA-N
Synonyms
488812-51-7
(E)3((3nitrobenzylidene)amino)2(phenoxymethyl)quinazolin4(3H)one
(O)(N+)(=O)c1cccc(c1)C=Nn1c(COc2ccccc2)nc2c(c1=O)cccc2
3(((E)(3nitrophenyl)methylidene)amino)2(phenoxymethyl)quinazolin4(3H)one
3((E)(3NITROPHENYL)METHYLIDENEAMINO)2(PHENOXYMETHYL)QUINAZOLIN4ONE
488812517
C1=CC=C(C=C1)OCC2=NC3=CC=CC=C3C(=O)N2N=CC4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC22H16N4O4c27221911451220(19)2421(15301892131018)25(22)23141676817(1316)26(28)29h114H15H2b2314+
MFCD02601169
ZINC000002359903
ZINC33362665

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Available files

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