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Duplicate ID | |
---|---|
Smiles | CCCCCCCCCCCCCCCCSc1ccc(cc1)NS(=O)(=O)c1ccccc1[N+](=O)[O-] |
Cas Number | |
InchiKey | LUCDJSKNDSDTKH-UHFFFAOYSA-N |
InChi | InChI=1S/C28H42N2O4S2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-24-35-26-22-20-25(21-23-26)29-36(33,34)28-19-16-15-18-27(28)30(31)32/h15-16,18-23,29H,2-14,17,24H2,1H3 |
Formula | C28H42N2O4S2 |
Molecular weight | 534.774 |
Rings | 2 |
logP | 10.646 |
PSA | 125.67 |
MR | 156.204 |