1-[3-ethylsulfonyl-5-(4-fluorophenyl)-4-methoxy-phenyl]-4-(pyridin-2-ylmethyl)piperazine

Systemtic Name: 1-[3-ethylsulfonyl-5-(4-fluorophenyl)-4-methoxy-phenyl]-4-(pyridin-2-ylmethyl)piperazine Openeye Name: 1-[3-ethylsulfonyl-5-(4-fluorophenyl)-4-methoxy-phenyl]-4-(2-pyridylmethyl)piperazine CAS Name: 1-[3-ethylsulfonyl-5-(4-fluorophenyl)-4-methoxyphenyl]-4-(2-pyridinylmethyl)piperazine IUPAC Name: 1-[3-ethylsulfonyl-5-(4-fluorophenyl)-4-methoxyphenyl]-4-(pyridin-2-ylmethyl)piperazine Traditional Name: 1-[3-esyl-5-(4-fluorophenyl)-4-methoxy-phenyl]-4-(2-pyridylmethyl)piperazine Formula: C25H28FN3O3S MolecularWeight: 469.571523

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=C(C(=CC(=C1)N2CCN(CC2)CC3=CC=CC=N3)C4=CC=C(C=C4)F)OC

Isomeric SMILES

CCS(=O)(=O)C1=C(C(=CC(=C1)N2CCN(CC2)CC3=CC=CC=N3)C4=CC=C(C=C4)F)OC

InChI

InChI=1S/C25H28FN3O3S/c1-3-33(30,31)24-17-22(16-23(25(24)32-2)19-7-9-20(26)10-8-19)29-14-12-28(13-15-29)18-21-6-4-5-11-27-21/h4-11,16-17H,3,12-15,18H2,1-2H3