N-[2-(3-ethoxypiperazin-1-yl)-2-(4-phenylphenyl)ethyl]propane-2-sulfonamide

Systemtic Name: N-[2-(3-ethoxypiperazin-1-yl)-2-(4-phenylphenyl)ethyl]propane-2-sulfonamide Openeye Name: N-[2-(3-ethoxypiperazin-1-yl)-2-(4-phenylphenyl)ethyl]propane-2-sulfonamide CAS Name: N-[2-(3-ethoxy-1-piperazinyl)-2-(4-phenylphenyl)ethyl]-2-propanesulfonamide IUPAC Name: N-[2-(3-ethoxypiperazin-1-yl)-2-(4-phenylphenyl)ethyl]propane-2-sulfonamide Traditional Name: N-[2-(3-ethoxypiperazino)-2-(4-phenylphenyl)ethyl]propane-2-sulfonamide Formula: C23H33N3O3S MolecularWeight: 431.59142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1CN(CCN1)C(CNS(=O)(=O)C(C)C)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CCOC1CN(CCN1)C(CNS(=O)(=O)C(C)C)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C23H33N3O3S/c1-4-29-23-17-26(15-14-24-23)22(16-25-30(27,28)18(2)3)21-12-10-20(11-13-21)19-8-6-5-7-9-19/h5-13,18,22-25H,4,14-17H2,1-3H3