5-chloranyl-8-[4-[4-(5-fluoranyl-1-benzothiophen-3-yl)cyclohexyl]piperazin-1-yl]quinoline

Systemtic Name: 5-chloranyl-8-[4-[4-(5-fluoranyl-1-benzothiophen-3-yl)cyclohexyl]piperazin-1-yl]quinoline Openeye Name: 5-chloro-8-[4-[4-(5-fluorobenzothiophen-3-yl)cyclohexyl]piperazin-1-yl]quinoline CAS Name: 5-chloro-8-[4-[4-(5-fluoro-1-benzothiophen-3-yl)cyclohexyl]-1-piperazinyl]quinoline IUPAC Name: 5-chloro-8-[4-[4-(5-fluoro-1-benzothiophen-3-yl)cyclohexyl]piperazin-1-yl]quinoline Traditional Name: 5-chloro-8-[4-[4-(5-fluorobenzothiophen-3-yl)cyclohexyl]piperazino]quinoline Formula: C27H27ClFN3S MolecularWeight: 480.039783

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C2=CSC3=C2C=C(C=C3)F)N4CCN(CC4)C5=C6C(=C(C=C5)Cl)C=CC=N6

Isomeric SMILES

C1CC(CCC1C2=CSC3=C2C=C(C=C3)F)N4CCN(CC4)C5=C6C(=C(C=C5)Cl)C=CC=N6

InChI

InChI=1S/C27H27ClFN3S/c28-24-8-9-25(27-21(24)2-1-11-30-27)32-14-12-31(13-15-32)20-6-3-18(4-7-20)23-17-33-26-10-5-19(29)16-22(23)26/h1-2,5,8-11,16-18,20H,3-4,6-7,12-15H2