| Properties | Image |
|---|
| MNX_ID | MNXM38045 |
 |
| reference | chebi:52197 |
| formula | C20H15BN4 |
| global charge | 0 |
| mol weight | 322.18 |
| InChIKey | YOCYALJMOMMNNJ-DRCNEUIKSA-N |
| InChI | InChI=1S/C20H15BN4/c21-20-18-7-5-16(24-18)10-14-3-1-12(22-14)9-13-2-4-15(23-13)11-17-6-8-19(20)25-17/h1-11,22,25H,21H2/b12-9-,13-9-,14-10-,15-11-,16-10-,17-11-,20-18+,20-19+ |
| SMILES | B/C1=C2\C=CC(=N2)/C=C2/C=C/C(=C/C3=N/C(=C\C4=CC=C1N4)C=C3)N2 |
MNX internals
| InChI (mnx) | InChI=1/C20H15BN4/c21-20-18-7-5-16(24-18)10-14-3-1-12(22-14)9-13-2-4-15(23-13)11-17-6-8-19(20)25-17/h1-11,22,25H,21H2/b12-9-,13-9-,14-10-,15-11-,16-10-,17-11-,20-18+,20-19+ |
 |
| SMILES (mnx) | [CH:1]1=[CH:3]\[C:14]2=[CH:10]\[C:16]3=[N:24]/[C:18](=[C:20](/[BH2:21])[C:19]4=[CH:8][CH:6]=[C:17](/[CH:11]=[C:15]5/[CH:4]=[CH:2][C:13](=[N:23]5)/[CH:9]=[C:12]/1[NH:22]2)[NH:25]4)[CH:7]=[CH:5]3 |
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