| Properties | Image | Occurences in reactions |
MNX_ID | MNXM1364136 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C21H23ClN2S |
charge | 0 |
mass | 370.939 |
reference | seedM:cpd31585 |
InChIKey | GRQUFNAGGOBDNI-CMWLGVBASA-N |
InChI | InChI=1S/C21H23ClN2S/c1-5-21(4)18(22)10-15(13(2)3)19(20(21)24-12-25)16-11-23-17-9-7-6-8-14(16)17/h5-9,11,15,18-20,23H,1-2,10H2,3-4H3/t15-,18-,19+,20-,21-/m1/s1 |
SMILES | [CH2:1]=[CH:5][C@:21]1([CH3:4])[C@H:18]([Cl:22])[CH2:10][C@H:15]([C:13](=[CH2:2])[CH3:3])[C@@H:19]([c:16]2[cH:11][nH:23][c:17]3[cH:9][cH:7][cH:6][cH:8][c:14]23)[C@H:20]1[N:24]=[C:12]=[S:25] |
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