| Properties | Image |
| MNX_ID | MNXM1121411 |
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| reference | chebi:158799 |
| formula | C20H20N4O2 |
| global charge | 0 |
| mol weight | 348.406 |
| InChIKey | AEVYTKKOGUOZJH-UHFFFAOYSA-N |
| InChI | InChI=1S/C20H20N4O2/c1-13-14(8-9-18(25)23-10-4-5-11-23)20(26)24-17-7-3-2-6-16(17)22-19(24)15(13)12-21/h2-3,6-7,22H,4-5,8-11H2,1H3 |
| SMILES | CC1=C(CCC(=O)N2CCCC2)C(=O)N2C3=C(C=CC=C3)NC2=C1C#N |
MNX internals
| InChI (mnx) | InChI=1/C20H20N4O2/c1-13-14(8-9-18(25)23-10-4-5-11-23)20(26)24-17-7-3-2-6-16(17)22-19(24)15(13)12-21/h2-3,6-7,22H,4-5,8-11H2,1H3 |
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| SMILES (mnx) | [CH3:1][C:13]1=[C:14]([CH2:8][CH2:9][C:18]([N:23]2[CH2:10][CH2:4][CH2:5][CH2:11]2)=[O:25])[C:20](=[O:26])[N:24]2[C:17]3=[CH:7][CH:3]=[CH:2][CH:6]=[C:16]3[NH:22][C:19]2=[C:15]1[C:12]#[N:21] |
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