Vitas-M small molecule compound

2-ethyl-11-(9-ethyl-9H-carbazol-3-yl)-3-hexyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one

Catalog ID
STK714218
SMILES CCCCCCn1c(CC)nc2c(c1=O)c1nc3ccccc3nc1n2c1ccc2c(c1)c1ccccc1n2CC

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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 C34H34N6O MW 542.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H34N6O/c1-4-7-8-13-20-39-29(5-2)37-32-30(34(39)41)31-33(36-26-16-11-10-15-25(26)35-31)40(32)22-18-19-28-24(21-22)23-14-9-12-17-27(23)38(28)6-3/h9-12,14-19,21H,4-8,13,20H2,1-3H3
InChIKey
XMEIERBGQIUZBG-UHFFFAOYSA-N
Synonyms

2ethyl11(9ethyl9Hcarbazol3yl)3hexyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
2ethyl11(9ethyl9Hcarbazol3yl)3hexyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
CCCCCCN1C(=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2C5=CC6=C(C=C5)N(C7=CC=CC=C76)CC)CC
InChI=1SC34H34N6Oc147813203929(52)373230(34(39)41)3133(36261611101525(26)3531)40(32)2218192824(2122)23149121727(23)38(28)63h912141921H481320H213H3
MFCD02993704
ZINC000002301238
ZINC2301238

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Available files

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