Vitas-M small molecule compound
pentyl 2-{[(2E)-3-phenylprop-2-enoyl]amino}-1-(prop-2-en-1-yl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Catalog ID
STL327566
SMILES CCCCCOC(=O)c1c(NC(=O)/C=C/c2ccccc2)n(c2c1nc1ccccc1n2)CC=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 C28H28N4O3 MW 468.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N4O3/c1-3-5-11-19-35-28(34)24-25-27(30-22-15-10-9-14-21(22)29-25)32(18-4-2)26(24)31-23(33)17-16-20-12-7-6-8-13-20/h4,6-10,12-17H,2-3,5,11,18-19H2,1H3,(H,31,33)/b17-16+InChIKey
MNGMXKWTVBLOET-WUKNDPDISA-NSynonyms
373616-75-2373616752
CCCCCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CC=C)NC(=O)C=CC4=CC=CC=C4
CCCCCOC(=O)c1c(NC(=O)C=Cc2ccccc2)n(c2c1nc1ccccc1n2)CC=C
InChI=1SC28H28N4O3c13511193528(34)242527(3022151091421(22)2925)32(1842)26(24)3123(33)171620127681320h46101217H235111819H21H3(H3133)b1716+
MFCD01948479
pentyl1allyl2cinnamamido1Hpyrrolo(23b)quinoxaline3carboxylate
pentyl2(((2E)3phenylprop2enoyl)amino)1(prop2en1yl)1Hpyrrolo(23b)quinoxaline3carboxylate
PENTYL2(((E)3PHENYLPROP2ENOYL)AMINO)1PROP2ENYLPYRROLO(32B)QUINOXALINE3CARBOXYLATE
ZINC000002281504
ZINC02281504
ZINC2281504
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