[3-ethoxy-4-(pyridin-3-ylmethoxy)phenyl]-[4-(phenylsulfonyl)piperazin-1-yl]methanone

Systemtic Name: [3-ethoxy-4-(pyridin-3-ylmethoxy)phenyl]-[4-(phenylsulfonyl)piperazin-1-yl]methanone Openeye Name: [4-(benzenesulfonyl)piperazin-1-yl]-[3-ethoxy-4-(3-pyridylmethoxy)phenyl]methanone CAS Name: [4-(benzenesulfonyl)-1-piperazinyl]-[3-ethoxy-4-(3-pyridinylmethoxy)phenyl]methanone IUPAC Name: [4-(benzenesulfonyl)piperazin-1-yl]-[3-ethoxy-4-(pyridin-3-ylmethoxy)phenyl]methanone Traditional Name: (4-besylpiperazino)-[3-ethoxy-4-(3-pyridylmethoxy)phenyl]methanone Formula: C25H27N3O5S MolecularWeight: 481.56398

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)OCC4=CN=CC=C4

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)OCC4=CN=CC=C4

InChI

InChI=1S/C25H27N3O5S/c1-2-32-24-17-21(10-11-23(24)33-19-20-7-6-12-26-18-20)25(29)27-13-15-28(16-14-27)34(30,31)22-8-4-3-5-9-22/h3-12,17-18H,2,13-16,19H2,1H3