Molecular Structure:
CCD No.:CCD00270790
VITAS-BB TBB025064
Formula:C16H22N2OS
MolWeight:290.429
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| Product Name： | VITAS-BB TBB025064 |
| English Synonyms： | VITAS-BB TBB025064 |
| MDL Number.： | MFCD01920233 |
| H bond acceptor： | 3 |
| H bond donor： | 1 |
| Smile： | CCC(CC)C(=O)NC1=C(C#N)C2=C(CC(C)CC2)S1 |
| InChi： | InChI=1S/C16H22N2OS/c1-4-11(5-2)15(19)18-16-13(9-17)12-7-6-10(3)8-14(12)20-16/h10-11H,4-8H2,1-3H3,(H,18,19) |
| InChiKey： | InChIKey=NNZHXZIULLTMKX-UHFFFAOYSA-N |
Basic Information
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