U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C11H10BrN5O2
Molecular Weight 324.133
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of HYMENIALDISINE

SMILES

NC1=N\C(C(=O)N1)=C2\CCNC(=O)C3=C2C=C(Br)N3

InChI

InChIKey=ATBAETXFFCOZOY-DAXSKMNVSA-N
InChI=1S/C11H10BrN5O2/c12-6-3-5-4(7-10(19)17-11(13)16-7)1-2-14-9(18)8(5)15-6/h3,15H,1-2H2,(H,14,18)(H3,13,16,17,19)/b7-4-

HIDE SMILES / InChI

Approval Year