Vitas-M small molecule compound
11-(4-chloro-3-nitrophenyl)-3-(3-methylbutyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK990491
SMILES CC(CCn1cnc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(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 C23H19ClN6O3 MW 462.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19ClN6O3/c1-13(2)9-10-28-12-25-21-19(23(28)31)20-22(27-17-6-4-3-5-16(17)26-20)29(21)14-7-8-15(24)18(11-14)30(32)33/h3-8,11-13H,9-10H2,1-2H3InChIKey
GBYSSXCDSVBPIK-UHFFFAOYSA-NSynonyms
713085-39-311(4chloro3nitrophenyl)3(3methylbutyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
11(4chloro3nitrophenyl)3isopentyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
713085393
CC(C)CCN1C=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2C5=CC(=C(C=C5)Cl)(N+)(=O)(O)
CC(CCn1cnc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(c(c1)(N+)(=O)(O))Cl)C
InChI=1SC23H19ClN6O3c113(2)9102812252119(23(28)31)2022(2717643516(17)2620)29(21)147815(24)18(1114)30(32)33h381113H910H212H3
MFCD04190495
ZINC000008871125
ZINC08871125
ZINC8871125
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