SpectraBase Spectrum ID |
C4KCBzvSoJg |
Name |
7,9-Diamino-11-(4-bromo-phenyl)-11,11a-dihydro-10H-5,6,8,10-tetraaza-dibenzo[a,g]azulen-12-one |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C20H15BrN6O |
InChI |
InChI=1S/C20H15BrN6O/c21-10-7-5-9(6-8-10)14-13-15(11-3-1-2-4-12(11)17(13)28)25-19-16(24-14)18(22)26-20(23)27-19/h1-8,13-14,24H,(H4,22,23,26,27) |
InChIKey |
CQSQPZXMTXSPLK-UHFFFAOYSA-N |
Molecular Weight |
435.285 g/mol |
SMILES |
Nc1nc(c2c(n1)N=C1C(C(c3ccccc13)=O)C(N2)c1ccc(cc1)Br)N |
SPLASH |
splash10-0f80-0050900000-d75a85ff2589b0af0e03 |
Source of Spectrum |
Y-45-1663-7c |
Synonyms |
9,11-Diamino-6-(4-bromophenyl)-6,7-dihydroindeno[1,2-e]-pyrimido[4,5-b][1,4]diazepin-5(5aH)-one |
Wiley ID |
1666529 |