| Properties | Image |
| MNX_ID | MNXM1593418 |
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| reference | vmhM:avanm1 vmhM:avanm1 |
| formula | C23H24ClN7O3 |
| global charge | 0 |
| mol weight | 481.944 |
| InChIKey | DRSXROKVGXUIRK-MRXNPFEDSA-N |
| InChI | InChI=1S/C23H24ClN7O3/c1-34-19-6-5-15(10-18(19)24)11-27-21-17(22(33)28-13-20-25-7-3-8-26-20)12-29-23(30-21)31-9-2-4-16(31)14-32/h2-8,10,12,16,32H,9,11,13-14H2,1H3,(H,28,33)(H,27,29,30)/t16-/m1/s1 |
| SMILES | COc1ccc(CNc2nc(N3CC=C[C@@H]3CO)ncc2C(=O)NCc2ncccn2)cc1Cl |
MNX internals
| InChI (mnx) | InChI=1/C23H24ClN7O3/c1-34-19-6-5-15(10-18(19)24)11-27-21-17(22(33)28-13-20-25-7-3-8-26-20)12-29-23(30-21)31-9-2-4-16(31)14-32/h2-8,10,12,16,32H,9,11,13-14H2,1H3,(H,28,33)(H,27,29,30)/t16-/m1/s1 |
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| SMILES (mnx) | [CH3:1][O:34][c:19]1[cH:6][cH:5][c:15]([CH2:11][NH:27][c:21]2[c:17]([C:22]([NH:28][CH2:13][c:20]3[n:25][cH:7][cH:3][cH:8][n:26]3)=[O:33])[cH:12][n:29][c:23]([N:31]3[CH2:9][CH:2]=[CH:4][C@@H:16]3[CH2:14][OH:32])[n:30]2)[cH:10][c:18]1[Cl:24] |
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