N-(4-ethoxyphenyl)-3-(4-methylsulfonylpiperazin-1-yl)carbonyl-benzenesulfonamide

Systemtic Name: N-(4-ethoxyphenyl)-3-(4-methylsulfonylpiperazin-1-yl)carbonyl-benzenesulfonamide Openeye Name: N-(4-ethoxyphenyl)-3-(4-methylsulfonylpiperazine-1-carbonyl)benzenesulfonamide CAS Name: N-(4-ethoxyphenyl)-3-[(4-methylsulfonyl-1-piperazinyl)-oxomethyl]benzenesulfonamide IUPAC Name: N-(4-ethoxyphenyl)-3-(4-methylsulfonylpiperazine-1-carbonyl)benzenesulfonamide Traditional Name: 3-(4-mesylpiperazine-1-carbonyl)-N-p-phenetyl-benzenesulfonamide Formula: C20H25N3O6S2 MolecularWeight: 467.559

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C20H25N3O6S2/c1-3-29-18-9-7-17(8-10-18)21-31(27,28)19-6-4-5-16(15-19)20(24)22-11-13-23(14-12-22)30(2,25)26/h4-10,15,21H,3,11-14H2,1-2H3