2-[3-[5-(4-fluorophenyl)-1-(4-methylphenyl)sulfonyl-pyrrolidin-2-yl]propyl]pyrimidine

Systemtic Name: 2-[3-[5-(4-fluorophenyl)-1-(4-methylphenyl)sulfonyl-pyrrolidin-2-yl]propyl]pyrimidine Openeye Name: 2-[3-[5-(4-fluorophenyl)-1-(p-tolylsulfonyl)pyrrolidin-2-yl]propyl]pyrimidine CAS Name: 2-[3-[5-(4-fluorophenyl)-1-(4-methylphenyl)sulfonyl-2-pyrrolidinyl]propyl]pyrimidine IUPAC Name: 2-[3-[5-(4-fluorophenyl)-1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]propyl]pyrimidine Traditional Name: 2-[3-[5-(4-fluorophenyl)-1-tosyl-pyrrolidin-2-yl]propyl]pyrimidine Formula: C24H26FN3O2S MolecularWeight: 439.545543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(CCC2C3=CC=C(C=C3)F)CCCC4=NC=CC=N4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(CCC2C3=CC=C(C=C3)F)CCCC4=NC=CC=N4

InChI

InChI=1S/C24H26FN3O2S/c1-18-6-13-22(14-7-18)31(29,30)28-21(4-2-5-24-26-16-3-17-27-24)12-15-23(28)19-8-10-20(25)11-9-19/h3,6-11,13-14,16-17,21,23H,2,4-5,12,15H2,1H3