Molecular Structure:
CCD No.:CCD00239774
8-CYCLOPENTYLTHIO-THEOPHYLLINE
CAS No.:
74039-72-8
Formula:C12 H16 N4 O2 S
MolWeight:280.35
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| Product Name： | 8-CYCLOPENTYLTHIO-THEOPHYLLINE |
| CAS： | 74039-72-8 |
| English Synonyms： | 8-CYCLOPENTYLTHIO-THEOPHYLLINE ; THEOPHYLLINE, 8-CYCLOPENTYLTHIO- |
| MDL Number.： | MFCD01682328 |
| H bond acceptor： | 6 |
| H bond donor： | 1 |
| Smile： | Cn1c2c(c(=O)n(c1=O)C)[nH]c(n2)SC3CCCC3 |
| InChi： | InChI=1S/C12H16N4O2S/c1-15-9-8(10(17)16(2)12(15)18)13-11(14-9)19-7-5-3-4-6-7/h7H,3-6H2,1-2H3,(H,13,14) |
| InChiKey： | InChIKey=MEMVDDHMDYKKGA-UHFFFAOYSA-N |
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