Vitas-M small molecule compound
11-(3,5-dimethylphenyl)-3-heptyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK990431
SMILES CCCCCCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2c1cc(C)cc(c1)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 C27H29N5O MW 439.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N5O/c1-4-5-6-7-10-13-31-17-28-25-23(27(31)33)24-26(30-22-12-9-8-11-21(22)29-24)32(25)20-15-18(2)14-19(3)16-20/h8-9,11-12,14-17H,4-7,10,13H2,1-3H3InChIKey
QQNVZOSAGNARSD-UHFFFAOYSA-NSynonyms
845899-97-011(35dimethylphenyl)3heptyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
11(35dimethylphenyl)3heptyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
845899970
CCCCCCCN1C=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2C5=CC(=CC(=C5)C)C
InChI=1SC27H29N5Oc1456710133117282523(27(31)33)2426(302212981121(22)2924)32(25)201518(2)1419(3)1620h8911121417H471013H213H3
MFCD04172772
ZINC000002407831
ZINC2407831
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