8-[4-[4-(5-fluoranyl-1-benzothiophen-3-yl)cyclohexyl]piperazin-1-yl]-6-methoxy-quinoline

Systemtic Name: 8-[4-[4-(5-fluoranyl-1-benzothiophen-3-yl)cyclohexyl]piperazin-1-yl]-6-methoxy-quinoline Openeye Name: 8-[4-[4-(5-fluorobenzothiophen-3-yl)cyclohexyl]piperazin-1-yl]-6-methoxy-quinoline CAS Name: 8-[4-[4-(5-fluoro-1-benzothiophen-3-yl)cyclohexyl]-1-piperazinyl]-6-methoxyquinoline IUPAC Name: 8-[4-[4-(5-fluoro-1-benzothiophen-3-yl)cyclohexyl]piperazin-1-yl]-6-methoxyquinoline Traditional Name: 8-[4-[4-(5-fluorobenzothiophen-3-yl)cyclohexyl]piperazino]-6-methoxy-quinoline Formula: C28H30FN3OS MolecularWeight: 475.620703

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C(=C1)C=CC=N2)N3CCN(CC3)C4CCC(CC4)C5=CSC6=C5C=C(C=C6)F

Isomeric SMILES

COC1=CC(=C2C(=C1)C=CC=N2)N3CCN(CC3)C4CCC(CC4)C5=CSC6=C5C=C(C=C6)F

InChI

InChI=1S/C28H30FN3OS/c1-33-23-15-20-3-2-10-30-28(20)26(17-23)32-13-11-31(12-14-32)22-7-4-19(5-8-22)25-18-34-27-9-6-21(29)16-24(25)27/h2-3,6,9-10,15-19,22H,4-5,7-8,11-14H2,1H3