Vitas-M small molecule compound

N-{3-[(1E)-1-(2-{[2-(1,3-benzodioxol-5-yl)quinolin-4-yl]carbonyl}hydrazinylidene)ethyl]phenyl}-2,2,3,3,4,4,4-heptafluorobutanamide

Catalog ID
STK468574
SMILES O=C(C(C(C(F)(F)F)(F)F)(F)F)Nc1cccc(c1)/C(=N/NC(=O)c1cc(nc2c1cccc2)c1ccc2c(c1)OCO2)/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 C29H19F7N4O4 MW 620.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H19F7N4O4/c1-15(16-5-4-6-18(11-16)37-26(42)27(30,31)28(32,33)29(34,35)36)39-40-25(41)20-13-22(38-21-8-3-2-7-19(20)21)17-9-10-23-24(12-17)44-14-43-23/h2-13H,14H2,1H3,(H,37,42)(H,40,41)/b39-15+
InChIKey
YQSGSZQPLAZWQV-AATKOCIRSA-N
Synonyms

2(13benzodioxol5yl)N((E)1(3(2233444heptafluorobutanoylamino)phenyl)ethylideneamino)quinoline4carboxamide
CC(=NNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC4=C(C=C3)OCO4)C5=CC(=CC=C5)NC(=O)C(C(C(F)(F)F)(F)F)(F)F
InChI=1SC29H19F7N4O4c115(1654618(1116)3726(42)27(3031)28(3233)29(3435)36)394025(41)201322(3821832719(20)21)179102324(1217)44144323h213H14H21H3(H3742)(H4041)b3915+
MFCD07182627
N(3((1E)1(2((2(13benzodioxol5yl)quinolin4yl)carbonyl)hydrazinylidene)ethyl)phenyl)2233444heptafluorobutanamide
O=C(C(C(C(F)(F)F)(F)F)(F)F)Nc1cccc(c1)C(=NNC(=O)c1cc(nc2c1cccc2)c1ccc2c(c1)OCO2)C
ZINC000097965737
ZINC150670469

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Available files

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