Vitas-M small molecule compound

2-amino-N-hexyl-1-{[(E)-(3,4,5-trimethoxyphenyl)methylidene]amino}-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide

Catalog ID
STL146089
SMILES CCCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)/N=C/c1cc(OC)c(c(c1)OC)OC

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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 C27H32N6O4 MW 504.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N6O4/c1-5-6-7-10-13-29-27(34)22-23-26(32-19-12-9-8-11-18(19)31-23)33(25(22)28)30-16-17-14-20(35-2)24(37-4)21(15-17)36-3/h8-9,11-12,14-16H,5-7,10,13,28H2,1-4H3,(H,29,34)/b30-16+
InChIKey
UHEQHZJOYYXKPG-OKCVXOCRSA-N
Synonyms
836637-70-8
(E)2aminoNhexyl1((345trimethoxybenzylidene)amino)1Hpyrrolo(23b)quinoxaline3carboxamide
2aminoNhexyl1(((E)(345trimethoxyphenyl)methylidene)amino)1Hpyrrolo(23b)quinoxaline3carboxamide
2aminoNhexyl1((E)(345trimethoxyphenyl)methylideneamino)pyrrolo(32b)quinoxaline3carboxamide
836637708
CCCCCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)N=CC4=CC(=C(C(=C4)OC)OC)OC)N
CCCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)N=Cc1cc(OC)c(c(c1)OC)OC
InChI=1SC27H32N6O4c156710132927(34)222326(321912981118(19)3123)33(25(22)28)3016171420(352)24(374)21(1517)363h8911121416H57101328H214H3(H2934)b3016+
MFCD03689959
ZINC000011851713
ZINC33918659

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Available files

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