Vitas-M small molecule compound

3-{3-methoxy-4-[(4-methylbenzyl)oxy]phenyl}-N'-[(Z)-pyridin-3-ylmethylidene]-1H-pyrazole-5-carbohydrazide

Catalog ID
STK106554
SMILES COc1cc(ccc1OCc1ccc(cc1)C)c1n[nH]c(c1)C(=O)N/N=C\c1cccnc1

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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 C25H23N5O3 MW 441.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N5O3/c1-17-5-7-18(8-6-17)16-33-23-10-9-20(12-24(23)32-2)21-13-22(29-28-21)25(31)30-27-15-19-4-3-11-26-14-19/h3-15H,16H2,1-2H3,(H,28,29)(H,30,31)/b27-15-
InChIKey
OVGPJNMXMSHKET-DICXZTSXSA-N
Synonyms

(E)3(3methoxy4((4methylbenzyl)oxy)phenyl)N(pyridin3ylmethylene)1Hpyrazole5carbohydrazide
3(3METHOXY4((4METHYLBENZYL)OXY)PHENYL)N((Z)PYRIDIN3YLMETHYLIDENE)1HPYRAZOLE5CARBOHYDRAZIDE
3(3METHOXY4((4METHYLPHENYL)METHOXY)PHENYL)N((Z)PYRIDIN3YLMETHYLIDENEAMINO)1HPYRAZOLE5CARBOXAMIDE
CC1=CC=C(C=C1)COC2=C(C=C(C=C2)C3=NNC(=C3)C(=O)NN=CC4=CN=CC=C4)OC
COc1cc(ccc1OCc1ccc(cc1)C)c1n(nH)c(c1)C(=O)NN=Cc1cccnc1
InChI=1SC25H23N5O3c1175718(8617)16332310920(1224(23)322)211322(292821)25(31)302715194311261419h315H16H212H3(H2829)(H3031)b2715
MFCD04126550
N((1Z)2(3PYRIDYL)1AZAVINYL)(3(3METHOXY4((4METHYLPHENYL)METHOXY)PHENYL)PYRAZOL5YL)CARBOXAMIDE
ZINC000032519354
ZINC18167768

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Available files

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