Molecular Structure:
CCD No.:CCD00270798
VITAS-BB TBB016069
Formula:C15H16N2O3S
MolWeight:304.368
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| Product Name： | VITAS-BB TBB016069 |
| English Synonyms： | VITAS-BB TBB016069 |
| MDL Number.： | MFCD01920325 |
| H bond acceptor： | 5 |
| H bond donor： | 2 |
| Smile： | CCC1CCC2=C(C1)SC(NC(=O)\C=C\C(O)=O)=C2C#N |
| InChi： | InChI=1S/C15H16N2O3S/c1-2-9-3-4-10-11(8-16)15(21-12(10)7-9)17-13(18)5-6-14(19)20/h5-6,9H,2-4,7H2,1H3,(H,17,18)(H,19,20)/b6-5+ |
| InChiKey： | InChIKey=KBEMPPDUIDFFHB-AATRIKPKSA-N |
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