4-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]carbonyl-N-(2-methoxyethyl)benzenesulfonamide

Systemtic Name: 4-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]carbonyl-N-(2-methoxyethyl)benzenesulfonamide Openeye Name: 4-[4-[(4-cyanophenyl)methyl]piperazine-1-carbonyl]-N-(2-methoxyethyl)benzenesulfonamide CAS Name: 4-[[4-[(4-cyanophenyl)methyl]-1-piperazinyl]-oxomethyl]-N-(2-methoxyethyl)benzenesulfonamide IUPAC Name: 4-[4-[(4-cyanophenyl)methyl]piperazine-1-carbonyl]-N-(2-methoxyethyl)benzenesulfonamide Traditional Name: 4-[4-(4-cyanobenzyl)piperazine-1-carbonyl]-N-(2-methoxyethyl)benzenesulfonamide Formula: C22H26N4O4S MolecularWeight: 442.53124

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Descriptors Computed from Structure

Canonical SMILES:

COCCNS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=C(C=C3)C#N

Isomeric SMILES

COCCNS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H26N4O4S/c1-30-15-10-24-31(28,29)21-8-6-20(7-9-21)22(27)26-13-11-25(12-14-26)17-19-4-2-18(16-23)3-5-19/h2-9,24H,10-15,17H2,1H3