Vitas-M small molecule compound

3-(3-methylbutyl)-11-(4-methyl-3-nitrophenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one

Catalog ID
STK990480
SMILES CC(CCn1cnc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(c(c1)[N+](=O)[O-])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 C24H22N6O3 MW 442.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N6O3/c1-14(2)10-11-28-13-25-22-20(24(28)31)21-23(27-18-7-5-4-6-17(18)26-21)29(22)16-9-8-15(3)19(12-16)30(32)33/h4-9,12-14H,10-11H2,1-3H3
InChIKey
ZKXXULWWNNRUIA-UHFFFAOYSA-N
Synonyms
848766-54-1
3(3methylbutyl)11(4methyl3nitrophenyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3isopentyl11(4methyl3nitrophenyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
848766541
CC(CCn1cnc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(c(c1)(N+)(=O)(O))C)C
CC1=C(C=C(C=C1)N2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C=N3)CCC(C)C)(N+)(=O)(O)
InChI=1SC24H22N6O3c114(2)10112813252220(24(28)31)2123(2718754617(18)2621)29(22)169815(3)19(1216)30(32)33h491214H1011H213H3
MFCD04193126
ZINC000002242222
ZINC02242222
ZINC2242222

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Available files

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