Vitas-M small molecule compound

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

Catalog ID
STK107291
SMILES CCCCOc1ccc(cc1)c1n[nH]c(c1)C(=O)N/N=C\c1ccc(cc1)C(=O)OC

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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 C23H24N4O4 MW 420.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N4O4/c1-3-4-13-31-19-11-9-17(10-12-19)20-14-21(26-25-20)22(28)27-24-15-16-5-7-18(8-6-16)23(29)30-2/h5-12,14-15H,3-4,13H2,1-2H3,(H,25,26)(H,27,28)/b24-15-
InChIKey
ZNAPYBSEGZZARO-IWIPYMOSSA-N
Synonyms

(E)methyl4((2(3(4butoxyphenyl)1Hpyrazole5carbonyl)hydrazono)methyl)benzoate
CCCCOC1=CC=C(C=C1)C2=NNC(=C2)C(=O)NN=CC3=CC=C(C=C3)C(=O)OC
CCCCOc1ccc(cc1)c1n(nH)c(c1)C(=O)NN=Cc1ccc(cc1)C(=O)OC
InChI=1SC23H24N4O4c13413311911917(101219)201421(262520)22(28)272415165718(8616)23(29)302h5121415H3413H212H3(H2526)(H2728)b2415
METHYL4((Z)((3(4BUTOXYPHENYL)1HPYRAZOLE5CARBONYL)HYDRAZINYLIDENE)METHYL)BENZOATE
METHYL4((Z)(2((3(4BUTOXYPHENYL)1HPYRAZOL5YL)CARBONYL)HYDRAZINYLIDENE)METHYL)BENZOATE
MFCD04126549
ZINC000030743170
ZINC04981820
ZINC4981820

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Available files

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