| Properties | Image |
| MNX_ID | MNXM343267 |
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| reference | chebi:120415 |
| formula | C14H20N2O4S |
| global charge | 0 |
| mol weight | 312.391 |
| InChIKey | HZENCSYHMPFODX-UHFFFAOYSA-N |
| InChI | InChI=1S/C14H20N2O4S/c1-11(17)16-8-6-12-10-13(4-5-14(12)16)21(18,19)15-7-3-9-20-2/h4-5,10,15H,3,6-9H2,1-2H3 |
| SMILES | COCCCNS(=O)(=O)C1=CC2=C(C=C1)N(C(C)=O)CC2 |
MNX internals
| InChI (mnx) | InChI=1/C14H20N2O4S/c1-11(17)16-8-6-12-10-13(4-5-14(12)16)21(18,19)15-7-3-9-20-2/h4-5,10,15H,3,6-9H2,1-2H3 |
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| SMILES (mnx) | [CH3:1][C:11]([N:16]1[CH2:8][CH2:6][C:12]2=[C:14]1[CH:5]=[CH:4][C:13]([S:21]([NH:15][CH2:7][CH2:3][CH2:9][O:20][CH3:2])(=[O:18])=[O:19])=[CH:10]2)=[O:17] |
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