3-[4-(2-fluorophenyl)carbonylpiperazin-1-yl]-4-methoxy-N-(2-methoxyethyl)benzenesulfonamide

Systemtic Name: 3-[4-(2-fluorophenyl)carbonylpiperazin-1-yl]-4-methoxy-N-(2-methoxyethyl)benzenesulfonamide Openeye Name: 3-[4-(2-fluorobenzoyl)piperazin-1-yl]-4-methoxy-N-(2-methoxyethyl)benzenesulfonamide CAS Name: 3-[4-[(2-fluorophenyl)-oxomethyl]-1-piperazinyl]-4-methoxy-N-(2-methoxyethyl)benzenesulfonamide IUPAC Name: 3-[4-(2-fluorobenzoyl)piperazin-1-yl]-4-methoxy-N-(2-methoxyethyl)benzenesulfonamide Traditional Name: 3-[4-(2-fluorobenzoyl)piperazino]-4-methoxy-N-(2-methoxyethyl)benzenesulfonamide Formula: C21H26FN3O5S MolecularWeight: 451.511643

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Descriptors Computed from Structure

Canonical SMILES:

COCCNS(=O)(=O)C1=CC(=C(C=C1)OC)N2CCN(CC2)C(=O)C3=CC=CC=C3F

Isomeric SMILES

COCCNS(=O)(=O)C1=CC(=C(C=C1)OC)N2CCN(CC2)C(=O)C3=CC=CC=C3F

InChI

InChI=1S/C21H26FN3O5S/c1-29-14-9-23-31(27,28)16-7-8-20(30-2)19(15-16)24-10-12-25(13-11-24)21(26)17-5-3-4-6-18(17)22/h3-8,15,23H,9-14H2,1-2H3