Molecular Structure:
CAS No.:
205764-69-8
Product Name.:
CCD No.:CCD01230426
Formula:C12 H20 N6 O3 S
MolWeight:328.395
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| Product Name： | SIMAZINE MERCAPTURATE |
| CAS： | 205764-69-8 |
| English Synonyms： | SIMAZINE MERCAPTURATE |
| MDL Number.： | MFCD11616765 |
| H bond acceptor： | 9 |
| H bond donor： | 4 |
| Smile： | CCNc1nc(nc(n1)SC[C@@H](C(=O)O)NC(=O)C)NCC |
| InChi： | InChI=1S/C12H20N6O3S/c1-4-13-10-16-11(14-5-2)18-12(17-10)22-6-8(9(20)21)15-7(3)19/h8H,4-6H2,1-3H3,(H,15,19)(H,20,21)(H2,13,14,16,17,18)/t8-/m0/s1 |
| InChiKey： | InChIKey=CSQCJPSBEYLCBK-QMMMGPOBSA-N |
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