2-(4-diethylaminophenyl)-8-[(2-fluorophenyl)methylsulfanyl]-4-methylidene-N-(1H-pyridin-5-yl)-1,5,7,9-tetrazabicyclo[4.3.0]nona-5,7-diene-3-carboxamide
Molecular Formula:
C29H31FN7OS+
InChI: InChI=1/C29H30FN7OS/c1-4-36(5-2)23-14-12-20(13-15-23)26-25(27(38)33-22-10-8-16-31-17-22)19(3)32-28-34-29(35-37(26)28)39-18-21-9-6-7-11-24(21)30/h6-17,25-26H,3-5,18H2,1-2H3,(H,33,38)(H,32,34,35)/p+1/fC29H31FN7OS/h31,33,35H/q+1
InChIKey: InChIKey=OKQDTKQDNICLRO-HXGJWARXCO
SMILES: CCN(CC)C1=CC=C(C=C1)C2C(C(=C)N=C3N2NC(=N3)SCC4=CC=CC=C4F)C(=O)NC5=C[NH+]=CC=C5
Names:
2-(4-diethylaminophenyl)-8-[(2-fluorophenyl)methylsulfanyl]-4-methylidene-N-(1H-pyridin-5-yl)-1,5,7,9-tetrazabicyclo[4.3.0]nona-5,7-diene-3-carboxamide
Registries:
PubChem CID 6011539
PubChem ID 6031097
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