Vitas-M small molecule compound
methyl 4-{2-amino-3-[(3-methylbutyl)carbamoyl]-1H-pyrrolo[2,3-b]quinoxalin-1-yl}benzoate
Catalog ID
STL238379
SMILES COC(=O)c1ccc(cc1)n1c2nc3ccccc3nc2c(c1N)C(=O)NCCC(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 C24H25N5O3 MW 431.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N5O3/c1-14(2)12-13-26-23(30)19-20-22(28-18-7-5-4-6-17(18)27-20)29(21(19)25)16-10-8-15(9-11-16)24(31)32-3/h4-11,14H,12-13,25H2,1-3H3,(H,26,30)InChIKey
PNWBUBKLBCFBAN-UHFFFAOYSA-NSynonyms
587011-97-0587011970
CC(C)CCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC=C(C=C4)C(=O)OC)N
InChI=1SC24H25N5O3c114(2)12132623(30)192022(2818754617(18)2720)29(21(19)25)1610815(91116)24(31)323h41114H121325H213H3(H2630)
methyl4(2amino3((3methylbutyl)carbamoyl)1Hpyrrolo(23b)quinoxalin1yl)benzoate
METHYL4(2AMINO3(3METHYLBUTYLCARBAMOYL)PYRROLO(32B)QUINOXALIN1YL)BENZOATE
methyl4(2amino3(isopentylcarbamoyl)1Hpyrrolo(23b)quinoxalin1yl)benzoate
MFCD04034253
ZINC000002399243
ZINC02399243
ZINC2399243
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