Vitas-M small molecule compound
3-heptyl-2-methyl-11-(3-methylphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK568208
SMILES CCCCCCCn1c(C)nc2c(c1=O)c1nc3ccccc3nc1n2c1cccc(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/c1-4-5-6-7-10-16-31-19(3)28-25-23(27(31)33)24-26(30-22-15-9-8-14-21(22)29-24)32(25)20-13-11-12-18(2)17-20/h8-9,11-15,17H,4-7,10,16H2,1-3H3InChIKey
OFRHJWWNRXPRAP-UHFFFAOYSA-NSynonyms
848682-94-03heptyl2methyl11(3methylphenyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3heptyl2methyl11(mtolyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
848682940
CCCCCCCN1C(=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2C5=CC=CC(=C5)C)C
InChI=1SC27H29N5Oc1456710163119(3)282523(27(31)33)2426(302215981421(22)2924)32(25)2013111218(2)1720h89111517H471016H213H3
MFCD04191504
ZINC000002427329
ZINC2427329
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