4-ethyl-6-(4-ethylsulfonylpiperazin-1-yl)-5-[(3-fluorophenyl)methyl]-2-methyl-pyrimidine

Systemtic Name: 4-ethyl-6-(4-ethylsulfonylpiperazin-1-yl)-5-[(3-fluorophenyl)methyl]-2-methyl-pyrimidine Openeye Name: 4-ethyl-6-(4-ethylsulfonylpiperazin-1-yl)-5-[(3-fluorophenyl)methyl]-2-methyl-pyrimidine CAS Name: 4-ethyl-6-(4-ethylsulfonyl-1-piperazinyl)-5-[(3-fluorophenyl)methyl]-2-methylpyrimidine IUPAC Name: 4-ethyl-6-(4-ethylsulfonylpiperazin-1-yl)-5-[(3-fluorophenyl)methyl]-2-methylpyrimidine Traditional Name: 4-(4-esylpiperazino)-6-ethyl-5-(3-fluorobenzyl)-2-methyl-pyrimidine Formula: C20H27FN4O2S MolecularWeight: 406.517383

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)C)N2CCN(CC2)S(=O)(=O)CC)CC3=CC(=CC=C3)F

Isomeric SMILES

CCC1=C(C(=NC(=N1)C)N2CCN(CC2)S(=O)(=O)CC)CC3=CC(=CC=C3)F

InChI

InChI=1S/C20H27FN4O2S/c1-4-19-18(14-16-7-6-8-17(21)13-16)20(23-15(3)22-19)24-9-11-25(12-10-24)28(26,27)5-2/h6-8,13H,4-5,9-12,14H2,1-3H3