N-[3-[4-(2-fluorophenyl)piperazin-1-yl]sulfonylpropyl]-3,4,5-trimethoxy-benzamide

Systemtic Name: N-[3-[4-(2-fluorophenyl)piperazin-1-yl]sulfonylpropyl]-3,4,5-trimethoxy-benzamide Openeye Name: N-[3-[4-(2-fluorophenyl)piperazin-1-yl]sulfonylpropyl]-3,4,5-trimethoxy-benzamide CAS Name: N-[3-[[4-(2-fluorophenyl)-1-piperazinyl]sulfonyl]propyl]-3,4,5-trimethoxybenzamide IUPAC Name: N-[3-[4-(2-fluorophenyl)piperazin-1-yl]sulfonylpropyl]-3,4,5-trimethoxybenzamide Traditional Name: N-[3-[4-(2-fluorophenyl)piperazino]sulfonylpropyl]-3,4,5-trimethoxy-benzamide Formula: C23H30FN3O6S MolecularWeight: 495.564203

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NCCCS(=O)(=O)N2CCN(CC2)C3=CC=CC=C3F

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NCCCS(=O)(=O)N2CCN(CC2)C3=CC=CC=C3F

InChI

InChI=1S/C23H30FN3O6S/c1-31-20-15-17(16-21(32-2)22(20)33-3)23(28)25-9-6-14-34(29,30)27-12-10-26(11-13-27)19-8-5-4-7-18(19)24/h4-5,7-8,15-16H,6,9-14H2,1-3H3,(H,25,28)