Vitas-M small molecule compound

N~1~,N~1~-diethyl-N~4~-{6-methoxy-2-[(E)-2-(4-nitrophenyl)ethenyl]quinolin-4-yl}pentane-1,4-diamine

Catalog ID
STK097088
SMILES CCN(CCCC(Nc1cc(/C=C/c2ccc(cc2)[N+](=O)[O-])nc2c1cc(OC)cc2)C)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 C27H34N4O3 MW 462.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34N4O3/c1-5-30(6-2)17-7-8-20(3)28-27-18-22(29-26-16-15-24(34-4)19-25(26)27)12-9-21-10-13-23(14-11-21)31(32)33/h9-16,18-20H,5-8,17H2,1-4H3,(H,28,29)/b12-9+
InChIKey
XWBADQOPXPRKBX-FMIVXFBMSA-N
Synonyms
7195-14-4
(E)N1N1diethylN4(6methoxy2(4nitrostyryl)quinolin4yl)pentane14diaminephosphate
14PENTANEDIAMINEN1N1DIETHYLN4(6METHOXY2(2(4NITROPHENYL)ETHENYL)4QUINOLINYL)PHOSPHATE(13)
1N1NDIETHYL4N(6METHOXY2((E)2(4NITROPHENYL)ETHENYL)QUINOLIN4YL)PENTANE14DIAMINE
7195144
CCN(CC)CCCC(C)NC1=CC(=NC2=C1C=C(C=C2)OC)C=CC3=CC=C(C=C3)(N+)(=O)(O)
CCN(CCCC(Nc1cc(C=Cc2ccc(cc2)(N+)(=O)(O))nc2c1cc(OC)cc2)C)CC
InChI=1SC27H34N4O3c1530(62)177820(3)28271822(2926161524(344)1925(26)27)12921101323(141121)31(32)33h9161820H5817H214H3(H2829)b129+
MFCD00552961
N~1~N~1~diethylN~4~(6methoxy2((E)2(4nitrophenyl)ethenyl)quinolin4yl)pentane14diamine
N1N1DIETHYLN4(6METHOXY2((E)2(4NITROPHENYL)ETHENYL)QUINOLIN4YL)PENTANE14DIAMINE
OP(=O)(O)OCCN(CCCC(Nc1cc(C=Cc2ccc(cc2)(N+)(=O)(O))nc2c1cc(OC)cc2)C)CC
STK097088
TRICHOMONACID
ZINC000008935087
ZINC000018143459

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Available files

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