1-[3-[4-[3-(pyridin-3-ylmethoxy)phenyl]carbonylpiperazin-1-yl]sulfonylphenyl]ethanone

Systemtic Name: 1-[3-[4-[3-(pyridin-3-ylmethoxy)phenyl]carbonylpiperazin-1-yl]sulfonylphenyl]ethanone Openeye Name: 1-[3-[4-[3-(3-pyridylmethoxy)benzoyl]piperazin-1-yl]sulfonylphenyl]ethanone CAS Name: 1-[3-[[4-[oxo-[3-(3-pyridinylmethoxy)phenyl]methyl]-1-piperazinyl]sulfonyl]phenyl]ethanone IUPAC Name: 1-[3-[4-[3-(pyridin-3-ylmethoxy)benzoyl]piperazin-1-yl]sulfonylphenyl]ethanone Traditional Name: 1-[3-[4-[3-(3-pyridylmethoxy)benzoyl]piperazino]sulfonylphenyl]ethanone Formula: C25H25N3O5S MolecularWeight: 479.5481

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)OCC4=CN=CC=C4

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)OCC4=CN=CC=C4

InChI

InChI=1S/C25H25N3O5S/c1-19(29)21-6-3-9-24(16-21)34(31,32)28-13-11-27(12-14-28)25(30)22-7-2-8-23(15-22)33-18-20-5-4-10-26-17-20/h2-10,15-17H,11-14,18H2,1H3