| Properties | Image |
|---|
| MNX_ID | MNXM529096 |
 |
| reference | chebi:107700 |
| formula | C22H25N5O |
| global charge | 0 |
| mol weight | 375.476 |
| InChIKey | OIXXVTLALOIFRP-UHFFFAOYSA-N |
| InChI | InChI=1S/C22H25N5O/c23-15-18-16-5-3-6-17(16)21(24-9-4-10-26-11-13-28-14-12-26)27-20-8-2-1-7-19(20)25-22(18)27/h1-2,7-8,24H,3-6,9-14H2 |
| SMILES | N#CC1=C2CCCC2=C(NCCCN2CCOCC2)N2C3=CC=CC=C3N=C12 |
MNX internals
| InChI (mnx) | InChI=1/C22H25N5O/c23-15-18-16-5-3-6-17(16)21(24-9-4-10-26-11-13-28-14-12-26)27-20-8-2-1-7-19(20)25-22(18)27/h1-2,7-8,24H,3-6,9-14H2 |
 |
| SMILES (mnx) | [CH:1]1=[CH:2][CH:8]=[C:20]2[C:19](=[CH:7]1)[N:25]=[C:22]1[C:18]([C:15]#[N:23])=[C:16]3[CH2:5][CH2:3][CH2:6][C:17]3=[C:21]([NH:24][CH2:9][CH2:4][CH2:10][N:26]3[CH2:11][CH2:13][O:28][CH2:14][CH2:12]3)[N:27]21 |
|