Molecular Structure:
CCD No.:CCD00470228
SYNTHON-LAB SL026747
Formula:C22 H14 Br N3 O6 S
MolWeight:528.338
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| Product Name： | SYNTHON-LAB SL026747 |
| English Synonyms： | SYNTHON-LAB SL026747 |
| MDL Number.： | MFCD04540118 |
| H bond acceptor： | 9 |
| H bond donor： | 1 |
| Smile： | COc1cc(ccc1c2ccc(o2)/C=C\3/C(=O)NC(=S)N(C3=O)c4ccc(cc4)Br)[N+](=O)[O-] |
| InChi： | InChI=1S/C22H14BrN3O6S/c1-31-19-10-14(26(29)30)6-8-16(19)18-9-7-15(32-18)11-17-20(27)24-22(33)25(21(17)28)13-4-2-12(23)3-5-13/h2-11H,1H3,(H,24,27,33)/b17-11- |
| InChiKey： | InChIKey=HVVBVUJITAXNHW-BOPFTXTBSA-N |
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