Vitas-M small molecule compound

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

Catalog ID
STK920881
SMILES Cc1cccc(c1)S(=O)(=O)c1c(N)n(c2c1nc1ccccc1n2)/N=C/c1ccc(cc1)N(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 C26H24N6O2S MW 484.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N6O2S/c1-17-7-6-8-20(15-17)35(33,34)24-23-26(30-22-10-5-4-9-21(22)29-23)32(25(24)27)28-16-18-11-13-19(14-12-18)31(2)3/h4-16H,27H2,1-3H3/b28-16+
InChIKey
UYAUENFBTMLFKO-LQKURTRISA-N
Synonyms
844654-66-6
(E)N1(4(dimethylamino)benzylidene)3(mtolylsulfonyl)1Hpyrrolo(23b)quinoxaline12diamine
1((E)(4(dimethylamino)phenyl)methylideneamino)3(3methylphenyl)sulfonylpyrrolo(32b)quinoxalin2amine
844654666
CC1=CC(=CC=C1)S(=O)(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)N=CC5=CC=C(C=C5)N(C)C)N
Cc1cccc(c1)S(=O)(=O)c1c(N)n(c2c1nc1ccccc1n2)N=Cc1ccc(cc1)N(C)C
InChI=1SC26H24N6O2Sc11776820(1517)35(3334)242326(30221054921(22)2923)32(25(24)27)281618111319(141218)31(2)3h416H27H213H3b2816+
MFCD04159396
N~1~((E)(4(dimethylamino)phenyl)methylidene)3((3methylphenyl)sulfonyl)1Hpyrrolo(23b)quinoxaline12diamine
N1((E)(4(DIMETHYLAMINO)PHENYL)METHYLIDENE)3((3METHYLPHENYL)SULFONYL)1HPYRROLO(23B)QUINOXALINE12DIAMINE
ZINC000008818473
ZINC102984229

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Available files

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