Vitas-M small molecule compound
3-methylbutyl 2-amino-1-(4-chloro-3-nitrophenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Catalog ID
STK989800
SMILES CC(CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)[N+](=O)[O-])Cl)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 C22H20ClN5O4 MW 453.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClN5O4/c1-12(2)9-10-32-22(29)18-19-21(26-16-6-4-3-5-15(16)25-19)27(20(18)24)13-7-8-14(23)17(11-13)28(30)31/h3-8,11-12H,9-10,24H2,1-2H3InChIKey
YVFVIRJKCGCCSK-UHFFFAOYSA-NSynonyms
714923-89-43methylbutyl2amino1(4chloro3nitrophenyl)1Hpyrrolo(23b)quinoxaline3carboxylate
3METHYLBUTYL2AMINO1(4CHLORO3NITROPHENYL)PYRROLO(32B)QUINOXALINE3CARBOXYLATE
714923894
CC(C)CCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC(=C(C=C4)Cl)(N+)(=O)(O))N
CC(CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)(N+)(=O)(O))Cl)C
InChI=1SC22H20ClN5O4c112(2)9103222(29)181921(2616643515(16)2519)27(20(18)24)137814(23)17(1113)28(30)31h381112H91024H212H3
isopentyl2amino1(4chloro3nitrophenyl)1Hpyrrolo(23b)quinoxaline3carboxylate
MFCD03686332
ZINC000001313518
ZINC01313518
ZINC1313518
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