Vitas-M small molecule compound
2-methylbutyl 2-amino-1-(3-chloro-4-fluorophenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Catalog ID
STK713716
SMILES CCC(COC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)Cl)F)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 C22H20ClFN4O2 MW 426.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClFN4O2/c1-3-12(2)11-30-22(29)18-19-21(27-17-7-5-4-6-16(17)26-19)28(20(18)25)13-8-9-15(24)14(23)10-13/h4-10,12H,3,11,25H2,1-2H3InChIKey
DQRZKBQMAHPXAR-UHFFFAOYSA-NSynonyms
843623-53-02methylbutyl2amino1(3chloro4fluorophenyl)1Hpyrrolo(23b)quinoxaline3carboxylate
2METHYLBUTYL2AMINO1(3CHLORO4FLUOROPHENYL)PYRROLO(32B)QUINOXALINE3CARBOXYLATE
843623530
CCC(C)COC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC(=C(C=C4)F)Cl)N
InChI=1SC22H20ClFN4O2c1312(2)113022(29)181921(2717754616(17)2619)28(20(18)25)138915(24)14(23)1013h41012H31125H212H3
MFCD04016613
ZINC000008836563
ZINC000008836564
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