Vitas-M small molecule compound

2-(4-butoxyphenyl)-N'-[(E)-(1-ethyl-3-methyl-1H-pyrazol-4-yl)methylidene]quinoline-4-carbohydrazide

Catalog ID
STK425447
SMILES CCCCOc1ccc(cc1)c1nc2ccccc2c(c1)C(=O)N/N=C/c1cn(nc1C)CC

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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 C27H29N5O2 MW 455.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N5O2/c1-4-6-15-34-22-13-11-20(12-14-22)26-16-24(23-9-7-8-10-25(23)29-26)27(33)30-28-17-21-18-32(5-2)31-19(21)3/h7-14,16-18H,4-6,15H2,1-3H3,(H,30,33)/b28-17+
InChIKey
OKHCPIVKRXUTKK-OGLMXYFKSA-N
Synonyms

2(4butoxyphenyl)N((E)(1ethyl3methyl1Hpyrazol4yl)methylidene)quinoline4carbohydrazide
2(4BUTOXYPHENYL)N((E)(1ETHYL3METHYLPYRAZOL4YL)METHYLIDENEAMINO)QUINOLINE4CARBOXAMIDE
CCCCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NN=CC4=CN(N=C4C)CC
CCCCOc1ccc(cc1)c1nc2ccccc2c(c1)C(=O)NN=Cc1cn(nc1C)CC
InChI=1SC27H29N5O2c146153422131120(121422)261624(239781025(23)2926)27(33)302817211832(52)3119(21)3h7141618H4615H213H3(H3033)b2817+
MFCD02375230
N((1E)2(1ETHYL3METHYLPYRAZOL4YL)1AZAVINYL)(2(4BUTOXYPHENYL)(4QUINOLYL))CARBOXAMIDE
ZINC000002109806
ZINC33348630

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Available files

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