N-[2-(3-fluorophenyl)ethyl]-3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-benzamide

Systemtic Name: N-[2-(3-fluorophenyl)ethyl]-3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-benzamide Openeye Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-[2-(3-fluorophenyl)ethyl]benzamide CAS Name: N-[2-(3-fluorophenyl)ethyl]-3-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]benzamide IUPAC Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-[2-(3-fluorophenyl)ethyl]benzamide Traditional Name: 3-(4-benzylpiperazino)sulfonyl-N-[2-(3-fluorophenyl)ethyl]benzamide Formula: C26H28FN3O3S MolecularWeight: 481.582223

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)C(=O)NCCC4=CC(=CC=C4)F

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)C(=O)NCCC4=CC(=CC=C4)F

InChI

InChI=1S/C26H28FN3O3S/c27-24-10-4-8-21(18-24)12-13-28-26(31)23-9-5-11-25(19-23)34(32,33)30-16-14-29(15-17-30)20-22-6-2-1-3-7-22/h1-11,18-19H,12-17,20H2,(H,28,31)