Halocyamine A

Molecular Formula: C27H28BrN7O5


InChI: InChI=1/C27H28BrN7O5/c28-17-2-3-19-16(11-32-21(19)9-17)5-6-31-25(38)13-33-27(40)22(7-15-1-4-23(36)24(37)8-15)35-26(39)20(29)10-18-12-30-14-34-18/h1-6,8-9,11-12,14,20,22,32,36-37H,7,10,13,29H2,(H,30,34)(H,31,38)(H,33,40)(H,35,39)/b6-5+/f/h31,33-35H

InChIKey: InChIKey=CPVIHXZWYJGUHZ-CJMCUZQMDS
SMILES: C1=CC(=C(C=C1CC(C(=O)NCC(=O)NC=CC2=CNC3=C2C=CC(=C3)Br)NC(=O)C(CC4=CN=CN4)N)O)O

Names:
    AIDS-135567
    AIDS135567
    Halocyamine A
    NSC635462
    2-Amino-N-(2-((2-((2-(6-bromo-1H-indol-3-yl)vinyl)amino)-2-oxoethyl)amino)-1-(3,4-dihydroxybenzyl)-2-oxoethyl)-3-(1H-imidazol-4-yl)propanamide
    2-[[2-amino-3-(3H-imidazol-4-yl)propanoyl]amino]-N-[[(E)-2-(6-bromo-1H-indol-3-yl)ethenyl]carbamoylmethyl]-3-(3,4-dihydroxyphenyl)propanamide

Registries:
    PubChem CID 5926075
    PubChem ID 231516