4-(4-ethylsulfonylpiperazin-1-yl)-5-[(4-fluorophenyl)methyl]-6-methyl-2-phenyl-pyrimidine

Systemtic Name: 4-(4-ethylsulfonylpiperazin-1-yl)-5-[(4-fluorophenyl)methyl]-6-methyl-2-phenyl-pyrimidine Openeye Name: 4-(4-ethylsulfonylpiperazin-1-yl)-5-[(4-fluorophenyl)methyl]-6-methyl-2-phenyl-pyrimidine CAS Name: 4-(4-ethylsulfonyl-1-piperazinyl)-5-[(4-fluorophenyl)methyl]-6-methyl-2-phenylpyrimidine IUPAC Name: 4-(4-ethylsulfonylpiperazin-1-yl)-5-[(4-fluorophenyl)methyl]-6-methyl-2-phenylpyrimidine Traditional Name: 4-(4-esylpiperazino)-5-(4-fluorobenzyl)-6-methyl-2-phenyl-pyrimidine Formula: C24H27FN4O2S MolecularWeight: 454.560183

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCN(CC1)C2=NC(=NC(=C2CC3=CC=C(C=C3)F)C)C4=CC=CC=C4

Isomeric SMILES

CCS(=O)(=O)N1CCN(CC1)C2=NC(=NC(=C2CC3=CC=C(C=C3)F)C)C4=CC=CC=C4

InChI

InChI=1S/C24H27FN4O2S/c1-3-32(30,31)29-15-13-28(14-16-29)24-22(17-19-9-11-21(25)12-10-19)18(2)26-23(27-24)20-7-5-4-6-8-20/h4-12H,3,13-17H2,1-2H3