N-[(2-chlorophenyl)methyl]-2-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]propanamide

Systemtic Name: N-[(2-chlorophenyl)methyl]-2-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]propanamide Openeye Name: N-[(2-chlorophenyl)methyl]-2-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]propanamide CAS Name: N-[(2-chlorophenyl)methyl]-2-[4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]propanamide IUPAC Name: N-[(2-chlorophenyl)methyl]-2-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]propanamide Traditional Name: N-(2-chlorobenzyl)-2-(4-p-phenetylsulfonylpiperazino)propionamide Formula: C22H28ClN3O4S MolecularWeight: 465.99342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C)C(=O)NCC3=CC=CC=C3Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C)C(=O)NCC3=CC=CC=C3Cl

InChI

InChI=1S/C22H28ClN3O4S/c1-3-30-19-8-10-20(11-9-19)31(28,29)26-14-12-25(13-15-26)17(2)22(27)24-16-18-6-4-5-7-21(18)23/h4-11,17H,3,12-16H2,1-2H3,(H,24,27)