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

Systemtic Name: N-(cyclohexylmethyl)-N-[3-(4-phenylpiperazin-1-yl)propyl]quinoline-8-sulfonamide Openeye Name: N-(cyclohexylmethyl)-N-[3-(4-phenylpiperazin-1-yl)propyl]quinoline-8-sulfonamide CAS Name: N-(cyclohexylmethyl)-N-[3-(4-phenyl-1-piperazinyl)propyl]-8-quinolinesulfonamide IUPAC Name: N-(cyclohexylmethyl)-N-[3-(4-phenylpiperazin-1-yl)propyl]quinoline-8-sulfonamide Traditional Name: N-(cyclohexylmethyl)-N-[3-(4-phenylpiperazino)propyl]quinoline-8-sulfonamide Formula: C29H38N4O2S MolecularWeight: 506.70262

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H38N4O2S/c34-36(35,28-16-7-12-26-13-8-17-30-29(26)28)33(24-25-10-3-1-4-11-25)19-9-18-31-20-22-32(23-21-31)27-14-5-2-6-15-27/h2,5-8,12-17,25H,1,3-4,9-11,18-24H2