N-[2-(3-ethoxypiperazin-1-yl)-4-propyl-phenyl]-1-phenyl-methanesulfonamide

Systemtic Name: N-[2-(3-ethoxypiperazin-1-yl)-4-propyl-phenyl]-1-phenyl-methanesulfonamide Openeye Name: N-[2-(3-ethoxypiperazin-1-yl)-4-propyl-phenyl]-1-phenyl-methanesulfonamide CAS Name: N-[2-(3-ethoxy-1-piperazinyl)-4-propylphenyl]-1-phenylmethanesulfonamide IUPAC Name: N-[2-(3-ethoxypiperazin-1-yl)-4-propylphenyl]-1-phenylmethanesulfonamide Traditional Name: N-[2-(3-ethoxypiperazino)-4-propyl-phenyl]-1-phenyl-methanesulfonamide Formula: C22H31N3O3S MolecularWeight: 417.56484

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1)NS(=O)(=O)CC2=CC=CC=C2)N3CCNC(C3)OCC

Isomeric SMILES

CCCC1=CC(=C(C=C1)NS(=O)(=O)CC2=CC=CC=C2)N3CCNC(C3)OCC

InChI

InChI=1S/C22H31N3O3S/c1-3-8-18-11-12-20(24-29(26,27)17-19-9-6-5-7-10-19)21(15-18)25-14-13-23-22(16-25)28-4-2/h5-7,9-12,15,22-24H,3-4,8,13-14,16-17H2,1-2H3