| Properties | Image |
| MNX_ID | MNXM167849 |
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| reference | sabiorkM:20756 |
| formula | C12H23N3O4S2 |
| global charge | 0 |
| mol weight | 337.467 |
| InChIKey | RUDRIZRGOLQSMX-UHFFFAOYSA-N |
| InChI | InChI=1S/C12H23N3O4S2/c1-20-5-3-8(14-10(16)7-13)11(17)15-9(12(18)19)4-6-21-2/h8-9H,3-7,13H2,1-2H3,(H,14,16)(H,15,17)(H,18,19) |
| SMILES | CSCCC(N=C(O)C(CCSC)N=C(O)CN)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C12H23N3O4S2/c1-20-5-3-8(14-10(16)7-13)11(17)15-9(12(18)19)4-6-21-2/h8-9H,3-7,13H2,1-2H3,(H,14,16)(H,15,17)(H,18,19)/t8?,9? |
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| SMILES (mnx) | [CH3:1][S:20][CH2:5][CH2:3][CH:8]([C:11](=[N:15][CH:9]([CH2:4][CH2:6][S:21][CH3:2])[C:12](=[O:18])[OH:19])[OH:17])[N:14]=[C:10]([CH2:7][NH2:13])[OH:16] |
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