| Properties | Image |
MNX_ID | MNXM819791 |
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reference | sabiorkM:31269 |
formula | C9H7N3O2S |
global charge | 0 |
mol weight | 221.241 |
InChIKey | ILQADRCJYUVSEN-UHFFFAOYSA-N |
InChI | InChI=1S/C9H7N3O2S/c13-7-2-1-5(4-10-7)3-6-8(14)12-9(15)11-6/h1-4H,(H,10,13)(H2,11,12,14,15) |
SMILES | O=C1C=CC(C=C2N=C(S)N=C2O)=CN1 |
MNX internals
InChI (mnx) | InChI=1/C9H7N3O2S/c13-7-2-1-5(4-10-7)3-6-8(14)12-9(15)11-6/h1-4H,(H,10,13)(H2,11,12,14,15)/b6-3? |
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SMILES (mnx) | [CH:1]1=[CH:2][C:7](=[O:13])[NH:10][CH:4]=[C:5]1[CH:3]=[C:6]1[C:8]([OH:14])=[N:12][C:9]([SH:15])=[N:11]1 |
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