Vitas-M small molecule compound

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

Catalog ID
STK920564
SMILES Clc1ccc(cc1)/C=N/n1c2nc3ccccc3nc2c(c1N)C(=O)NCc1ccccc1

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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 C25H19ClN6O MW 454.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19ClN6O/c26-18-12-10-17(11-13-18)15-29-32-23(27)21(25(33)28-14-16-6-2-1-3-7-16)22-24(32)31-20-9-5-4-8-19(20)30-22/h1-13,15H,14,27H2,(H,28,33)/b29-15+
InChIKey
KLCAZKKQSCPMDH-WKULSOCRSA-N
Synonyms
836637-64-0
(E)2aminoNbenzyl1((4chlorobenzylidene)amino)1Hpyrrolo(23b)quinoxaline3carboxamide
2aminoNbenzyl1(((E)(4chlorophenyl)methylidene)amino)1Hpyrrolo(23b)quinoxaline3carboxamide
2aminoNbenzyl1((E)(4chlorophenyl)methylideneamino)pyrrolo(32b)quinoxaline3carboxamide
836637640
C1=CC=C(C=C1)CNC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)N=CC5=CC=C(C=C5)Cl)N
Clc1ccc(cc1)C=Nn1c2nc3ccccc3nc2c(c1N)C(=O)NCc1ccccc1
InChI=1SC25H19ClN6Oc2618121017(111318)15293223(27)21(25(33)2814166213716)2224(32)3120954819(20)3022h11315H1427H2(H2833)b2915+
MFCD03689951
ZINC000008836135
ZINC33380669

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Available files

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