Vitas-M small molecule compound

3-[(3,4-dimethylphenyl)sulfonyl]-N~1~-[(E)-(2-methylphenyl)methylidene]-1H-pyrrolo[2,3-b]quinoxaline-1,2-diamine

Catalog ID
STK920905
SMILES Cc1ccccc1/C=N/n1c2nc3ccccc3nc2c(c1N)S(=O)(=O)c1ccc(c(c1)C)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 C26H23N5O2S MW 469.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N5O2S/c1-16-12-13-20(14-18(16)3)34(32,33)24-23-26(30-22-11-7-6-10-21(22)29-23)31(25(24)27)28-15-19-9-5-4-8-17(19)2/h4-15H,27H2,1-3H3/b28-15+
InChIKey
CMONAEISKRUCBX-RWPZCVJISA-N
Synonyms
844831-30-7
(E)3((34dimethylphenyl)sulfonyl)N1(2methylbenzylidene)1Hpyrrolo(23b)quinoxaline12diamine
3((34dimethylphenyl)sulfonyl)N~1~((E)(2methylphenyl)methylidene)1Hpyrrolo(23b)quinoxaline12diamine
3((34DIMETHYLPHENYL)SULFONYL)N1((E)(2METHYLPHENYL)METHYLIDENE)1HPYRROLO(23B)QUINOXALINE12DIAMINE
3(34DIMETHYLPHENYL)SULFONYL1((E)(2METHYLPHENYL)METHYLIDENEAMINO)PYRROLO(32B)QUINOXALIN2AMINE
844831307
CC1=C(C=C(C=C1)S(=O)(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)N=CC5=CC=CC=C5C)N)C
Cc1ccccc1C=Nn1c2nc3ccccc3nc2c(c1N)S(=O)(=O)c1ccc(c(c1)C)C
InChI=1SC26H23N5O2Sc116121320(1418(16)3)34(3233)242326(302211761021(22)2923)31(25(24)27)281519954817(19)2h415H27H213H3b2815+
MFCD04161931
ZINC000002406959
ZINC2406958

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.