Vitas-M small molecule compound

methyl 4-[(E)-(2-{[3-(naphthalen-2-yl)-1H-pyrazol-5-yl]carbonyl}hydrazinylidene)methyl]benzoate

Catalog ID
STK107778
SMILES COC(=O)c1ccc(cc1)/C=N/NC(=O)c1[nH]nc(c1)c1ccc2c(c1)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 C23H18N4O3 MW 398.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N4O3/c1-30-23(29)17-8-6-15(7-9-17)14-24-27-22(28)21-13-20(25-26-21)19-11-10-16-4-2-3-5-18(16)12-19/h2-14H,1H3,(H,25,26)(H,27,28)/b24-14+
InChIKey
CTUIFBQFFDDVPS-ZVHZXABRSA-N
Synonyms
1310345-07-3
(E)methyl4((2(3(naphthalen2yl)1Hpyrazole5carbonyl)hydrazono)methyl)benzoate
1310345073
COC(=O)C1=CC=C(C=C1)C=NNC(=O)C2=CC(=NN2)C3=CC4=CC=CC=C4C=C3
COC(=O)c1ccc(cc1)C=NNC(=O)c1(nH)nc(c1)c1ccc2c(c1)cccc2
InChI=1SC23H18N4O3c13023(29)178615(7917)14242722(28)211320(252621)19111016423518(16)1219h214H1H3(H2526)(H2728)b2414+
METHYL4((E)((3NAPHTHALEN2YL1HPYRAZOLE5CARBONYL)HYDRAZINYLIDENE)METHYL)BENZOATE
METHYL4((E)(2((3(NAPHTHALEN2YL)1HPYRAZOL5YL)CARBONYL)HYDRAZINYLIDENE)METHYL)BENZOATE
MFCD01533285
ZINC000006785915
ZINC33319868

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.