| Properties | Image |
| MNX_ID | MNXM341887 |
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| reference | chebi:109654 |
| formula | C14H14BrN3O2S |
| global charge | 0 |
| mol weight | 368.256 |
| InChIKey | ZBCDIULMPGHKDR-UHFFFAOYSA-N |
| InChI | InChI=1S/C14H14BrN3O2S/c1-8-3-4-9(2)10(7-8)16-14(21)18-17-13(19)11-5-6-12(15)20-11/h3-7H,1-2H3,(H,17,19)(H2,16,18,21) |
| SMILES | CC1=CC(NC(=S)NNC(=O)C2=CC=C(Br)O2)=C(C)C=C1 |
MNX internals
| InChI (mnx) | InChI=1/C14H14BrN3O2S/c1-8-3-4-9(2)10(7-8)16-14(21)18-17-13(19)11-5-6-12(15)20-11/h3-7H,1-2H3,(H,17,19)(H2,16,18,21) |
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| SMILES (mnx) | [CH3:1][C:8]1=[CH:7][C:10]([N:16]=[C:14]([NH:18][N:17]=[C:13]([C:11]2=[CH:5][CH:6]=[C:12]([Br:15])[O:20]2)[OH:19])[SH:21])=[C:9]([CH3:2])[CH:4]=[CH:3]1 |
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