1-[3-(4-fluorophenyl)-4-methoxy-5-propylsulfonyl-phenyl]-4-methyl-piperazine

Systemtic Name: 1-[3-(4-fluorophenyl)-4-methoxy-5-propylsulfonyl-phenyl]-4-methyl-piperazine Openeye Name: 1-[3-(4-fluorophenyl)-4-methoxy-5-propylsulfonyl-phenyl]-4-methyl-piperazine CAS Name: 1-[3-(4-fluorophenyl)-4-methoxy-5-propylsulfonylphenyl]-4-methylpiperazine IUPAC Name: 1-[3-(4-fluorophenyl)-4-methoxy-5-propylsulfonylphenyl]-4-methylpiperazine Traditional Name: 1-[3-(4-fluorophenyl)-4-methoxy-5-propylsulfonyl-phenyl]-4-methyl-piperazine Formula: C21H27FN2O3S MolecularWeight: 406.514083

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=C(C(=CC(=C1)N2CCN(CC2)C)C3=CC=C(C=C3)F)OC

Isomeric SMILES

CCCS(=O)(=O)C1=C(C(=CC(=C1)N2CCN(CC2)C)C3=CC=C(C=C3)F)OC

InChI

InChI=1S/C21H27FN2O3S/c1-4-13-28(25,26)20-15-18(24-11-9-23(2)10-12-24)14-19(21(20)27-3)16-5-7-17(22)8-6-16/h5-8,14-15H,4,9-13H2,1-3H3