Vitas-M small molecule compound

[6-chloro-2-(2,4-dimethylphenyl)quinolin-4-yl][4-(4-nitrophenyl)piperazin-1-yl]methanone

Catalog ID
STK434882
SMILES Clc1ccc2c(c1)c(cc(n2)c1ccc(cc1C)C)C(=O)N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-]

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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 C28H25ClN4O3 MW 500.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25ClN4O3/c1-18-3-9-23(19(2)15-18)27-17-25(24-16-20(29)4-10-26(24)30-27)28(34)32-13-11-31(12-14-32)21-5-7-22(8-6-21)33(35)36/h3-10,15-17H,11-14H2,1-2H3
InChIKey
VAVZIFSJZCEVSS-UHFFFAOYSA-N
Synonyms

(6chloro2(24dimethylphenyl)quinolin4yl)(4(4nitrophenyl)piperazin1yl)methanone
2(24DIMETHYLPHENYL)6CHLORO(4QUINOLYL)4(4NITROPHENYL)PIPERAZINYLKETONE
CC1=CC(=C(C=C1)C2=NC3=C(C=C(C=C3)Cl)C(=C2)C(=O)N4CCN(CC4)C5=CC=C(C=C5)(N+)(=O)(O))C
Clc1ccc2c(c1)c(cc(n2)c1ccc(cc1C)C)C(=O)N1CCN(CC1)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC28H25ClN4O3c1183923(19(2)1518)271725(241620(29)41026(24)3027)28(34)32131131(121432)215722(8621)33(35)36h3101517H1114H212H3
MFCD03942905
ZINC000020357083
ZINC20357083

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Available files

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