Vitas-M small molecule compound
pentyl 1-cyclohexyl-2-{[(2E)-3-phenylprop-2-enoyl]amino}-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Catalog ID
STK531724
SMILES CCCCCOC(=O)c1c(NC(=O)/C=C/c2ccccc2)n(c2c1nc1ccccc1n2)C1CCCCC1
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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 C31H34N4O3 MW 510.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H34N4O3/c1-2-3-12-21-38-31(37)27-28-30(33-25-18-11-10-17-24(25)32-28)35(23-15-8-5-9-16-23)29(27)34-26(36)20-19-22-13-6-4-7-14-22/h4,6-7,10-11,13-14,17-20,23H,2-3,5,8-9,12,15-16,21H2,1H3,(H,34,36)/b20-19+InChIKey
VHPDVQYLUKDSBI-FMQUCBEESA-NSynonyms
374103-69-2374103692
CCCCCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4CCCCC4)NC(=O)C=CC5=CC=CC=C5
CCCCCOC(=O)c1c(NC(=O)C=Cc2ccccc2)n(c2c1nc1ccccc1n2)C1CCCCC1
InChI=1SC31H34N4O3c12312213831(37)272830(33251811101724(25)3228)35(23158591623)29(27)3426(36)201922136471422h46710111314172023H2358912151621H21H3(H3436)b2019+
MFCD01953279
pentyl1cyclohexyl2(((2E)3phenylprop2enoyl)amino)1Hpyrrolo(23b)quinoxaline3carboxylate
PENTYL1CYCLOHEXYL2(((E)3PHENYLPROP2ENOYL)AMINO)PYRROLO(32B)QUINOXALINE3CARBOXYLATE
pentyl2cinnamamido1cyclohexyl1Hpyrrolo(23b)quinoxaline3carboxylate
ZINC000009334981
ZINC09334981
ZINC9334981
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