N-[4-(4-fluoranylphenoxy)butyl]-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[4-(4-fluoranylphenoxy)butyl]-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-[4-(4-fluorophenoxy)butyl]-3-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: N-[4-(4-fluorophenoxy)butyl]-3-[(3-oxo-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-[4-(4-fluorophenoxy)butyl]-3-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: N-[4-(4-fluorophenoxy)butyl]-3-(3-ketopiperazino)sulfonyl-benzamide Formula: C21H24FN3O5S MolecularWeight: 449.495763

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCCCCOC3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CC(=O)N1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCCCCOC3=CC=C(C=C3)F

InChI

InChI=1S/C21H24FN3O5S/c22-17-6-8-18(9-7-17)30-13-2-1-10-24-21(27)16-4-3-5-19(14-16)31(28,29)25-12-11-23-20(26)15-25/h3-9,14H,1-2,10-13,15H2,(H,23,26)(H,24,27)