Vitas-M small molecule compound

N-{4-[(1E)-1-(2-{[2-(4-butoxyphenyl)quinolin-4-yl]carbonyl}hydrazinylidene)ethyl]phenyl}cyclobutanecarboxamide

Catalog ID
STK420104
SMILES CCCCOc1ccc(cc1)c1nc2ccccc2c(c1)C(=O)N/N=C(/c1ccc(cc1)NC(=O)C1CCC1)\C

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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 C33H34N4O3 MW 534.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H34N4O3/c1-3-4-20-40-27-18-14-24(15-19-27)31-21-29(28-10-5-6-11-30(28)35-31)33(39)37-36-22(2)23-12-16-26(17-13-23)34-32(38)25-8-7-9-25/h5-6,10-19,21,25H,3-4,7-9,20H2,1-2H3,(H,34,38)(H,37,39)/b36-22+
InChIKey
YUERFPCIIWSDKO-HPNXWYHWSA-N
Synonyms
444924-98-5
2(4butoxyphenyl)N((E)1(4(cyclobutanecarbonylamino)phenyl)ethylideneamino)quinoline4carboxamide
444924985
CCCCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NN=C(C)C4=CC=C(C=C4)NC(=O)C5CCC5
CCCCOc1ccc(cc1)c1nc2ccccc2c(c1)C(=O)NN=C(c1ccc(cc1)NC(=O)C1CCC1)C
InChI=1SC33H34N4O3c134204027181424(151927)312129(2810561130(28)3531)33(39)373622(2)23121626(171323)3432(38)2587925h5610192125H347920H212H3(H3438)(H3739)b3622+
MFCD02372349
N(4((1E)1(2((2(4butoxyphenyl)quinolin4yl)carbonyl)hydrazinylidene)ethyl)phenyl)cyclobutanecarboxamide
N(4(N((2(4BUTOXYPHENYL)4QUINOLINYL)CARBONYL)ETHANEHYDRAZONOYL)PHENYL)CYCLOBUTANECARBOXAMIDE
ZINC000008455962
ZINC102178196

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Available files

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