Vitas-M small molecule compound

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

Catalog ID
STL226084
SMILES Fc1ccc(cc1)/C=N/n1c(N)c(c2c1nc1ccccc1n2)C(=O)NCCc1ccccc1

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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 C26H21FN6O MW 452.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21FN6O/c27-19-12-10-18(11-13-19)16-30-33-24(28)22(26(34)29-15-14-17-6-2-1-3-7-17)23-25(33)32-21-9-5-4-8-20(21)31-23/h1-13,16H,14-15,28H2,(H,29,34)/b30-16+
InChIKey
MSEPXIGZMJNZOU-OKCVXOCRSA-N
Synonyms
799836-25-2
(E)2amino1((4fluorobenzylidene)amino)Nphenethyl1Hpyrrolo(23b)quinoxaline3carboxamide
2amino1(((E)(4fluorophenyl)methylidene)amino)N(2phenylethyl)1Hpyrrolo(23b)quinoxaline3carboxamide
2amino1((E)(4fluorophenyl)methylideneamino)N(2phenylethyl)pyrrolo(32b)quinoxaline3carboxamide
2AMINO1((E)(4FLUOROPHENYL)METHYLIDENEAMINO)NPHENETHYLPYRROLO(32B)QUINOXALINE3CARBOXAMIDE
799836252
C1=CC=C(C=C1)CCNC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)N=CC5=CC=C(C=C5)F)N
Fc1ccc(cc1)C=Nn1c(N)c(c2c1nc1ccccc1n2)C(=O)NCCc1ccccc1
InChI=1SC26H21FN6Oc2719121018(111319)16303324(28)22(26(34)291514176213717)2325(33)3221954820(21)3123h11316H141528H2(H2934)b3016+
MFCD03685274
ZINC000002246891
ZINC33351510

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Available files

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