Vitas-M small molecule compound
3-[(4-methylphenyl)sulfonyl]-N~1~-{(E)-[4-(propan-2-yl)phenyl]methylidene}-1H-pyrrolo[2,3-b]quinoxaline-1,2-diamine
Catalog ID
STK714635
SMILES Cc1ccc(cc1)S(=O)(=O)c1c(N)n(c2c1nc1ccccc1n2)/N=C/c1ccc(cc1)C(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 C27H25N5O2S MW 483.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N5O2S/c1-17(2)20-12-10-19(11-13-20)16-29-32-26(28)25(35(33,34)21-14-8-18(3)9-15-21)24-27(32)31-23-7-5-4-6-22(23)30-24/h4-17H,28H2,1-3H3/b29-16+InChIKey
DCQQETOOULYLMZ-MUFRIFMGSA-NSynonyms
578700-50-2(E)N1(4isopropylbenzylidene)3tosyl1Hpyrrolo(23b)quinoxaline12diamine
3((4methylphenyl)sulfonyl)N~1~((E)(4(propan2yl)phenyl)methylidene)1Hpyrrolo(23b)quinoxaline12diamine
3((4METHYLPHENYL)SULFONYL)N1((E)(4(PROPAN2YL)PHENYL)METHYLIDENE)1HPYRROLO(23B)QUINOXALINE12DIAMINE
3(4METHYLPHENYL)SULFONYL1((E)(4PROPAN2YLPHENYL)METHYLIDENEAMINO)PYRROLO(32B)QUINOXALIN2AMINE
578700502
CC1=CC=C(C=C1)S(=O)(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)N=CC5=CC=C(C=C5)C(C)C)N
Cc1ccc(cc1)S(=O)(=O)c1c(N)n(c2c1nc1ccccc1n2)N=Cc1ccc(cc1)C(C)C
InChI=1SC27H25N5O2Sc117(2)20121019(111320)16293226(28)25(35(3334)2114818(3)91521)2427(32)3123754622(23)3024h417H28H213H3b2916+
MFCD04029291
ZINC000002387015
ZINC33364464
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.