N-(cyclohexylmethyl)-N-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]quinoline-8-sulfonamide

Systemtic Name: N-(cyclohexylmethyl)-N-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]quinoline-8-sulfonamide Openeye Name: N-(cyclohexylmethyl)-N-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]quinoline-8-sulfonamide CAS Name: N-(cyclohexylmethyl)-N-[3-[4-(4-fluorophenyl)-1-piperazinyl]propyl]-8-quinolinesulfonamide IUPAC Name: N-(cyclohexylmethyl)-N-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]quinoline-8-sulfonamide Traditional Name: N-(cyclohexylmethyl)-N-[3-[4-(4-fluorophenyl)piperazino]propyl]quinoline-8-sulfonamide Formula: C29H37FN4O2S MolecularWeight: 524.693083

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN(CCCN2CCN(CC2)C3=CC=C(C=C3)F)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

Isomeric SMILES

C1CCC(CC1)CN(CCCN2CCN(CC2)C3=CC=C(C=C3)F)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C29H37FN4O2S/c30-26-12-14-27(15-13-26)33-21-19-32(20-22-33)17-6-18-34(23-24-7-2-1-3-8-24)37(35,36)28-11-4-9-25-10-5-16-31-29(25)28/h4-5,9-16,24H,1-3,6-8,17-23H2