Vitas-M small molecule compound
(2E)-N-{1-benzyl-3-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]quinoxalin-2-yl}-3-phenylprop-2-enamide
Catalog ID
STL040857
SMILES Cc1ccc(cc1)S(=O)(=O)c1c(NC(=O)/C=C/c2ccccc2)n(c2c1nc1ccccc1n2)Cc1ccccc1
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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 C33H26N4O3S MW 558.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H26N4O3S/c1-23-16-19-26(20-17-23)41(39,40)31-30-32(35-28-15-9-8-14-27(28)34-30)37(22-25-12-6-3-7-13-25)33(31)36-29(38)21-18-24-10-4-2-5-11-24/h2-21H,22H2,1H3,(H,36,38)/b21-18+InChIKey
XFGNNFGFYOZQGQ-DYTRJAOYSA-NSynonyms
(2E)N(1benzyl3((4methylphenyl)sulfonyl)1Hpyrrolo(23b)quinoxalin2yl)3phenylprop2enamide
(E)N(1BENZYL3(4METHYLPHENYL)SULFONYLPYRROLO(32B)QUINOXALIN2YL)3PHENYLPROP2ENAMIDE
CC1=CC=C(C=C1)S(=O)(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CC5=CC=CC=C5)NC(=O)C=CC6=CC=CC=C6
Cc1ccc(cc1)S(=O)(=O)c1c(NC(=O)C=Cc2ccccc2)n(c2c1nc1ccccc1n2)Cc1ccccc1
InChI=1SC33H26N4O3Sc123161926(201723)41(3940)313032(352815981427(28)3430)37(2225126371325)33(31)3629(38)211824104251124h221H22H21H3(H3638)b2118+
MFCD01947175
N(1benzyl3tosyl1Hpyrrolo(23b)quinoxalin2yl)cinnamamide
ZINC000002594046
ZINC2594046
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