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

Systemtic Name: 4-ethyl-5-[(4-fluorophenyl)methyl]-2-methyl-6-(4-methylsulfonylpiperazin-1-yl)pyrimidine Openeye Name: 4-ethyl-5-[(4-fluorophenyl)methyl]-2-methyl-6-(4-methylsulfonylpiperazin-1-yl)pyrimidine CAS Name: 4-ethyl-5-[(4-fluorophenyl)methyl]-2-methyl-6-(4-methylsulfonyl-1-piperazinyl)pyrimidine IUPAC Name: 4-ethyl-5-[(4-fluorophenyl)methyl]-2-methyl-6-(4-methylsulfonylpiperazin-1-yl)pyrimidine Traditional Name: 4-ethyl-5-(4-fluorobenzyl)-6-(4-mesylpiperazino)-2-methyl-pyrimidine Formula: C19H25FN4O2S MolecularWeight: 392.490803

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25FN4O2S/c1-4-18-17(13-15-5-7-16(20)8-6-15)19(22-14(2)21-18)23-9-11-24(12-10-23)27(3,25)26/h5-8H,4,9-13H2,1-3H3