5-[(3-fluorophenyl)methyl]-2,4-dimethyl-6-(4-naphthalen-1-ylsulfonylpiperazin-1-yl)pyrimidine

Systemtic Name: 5-[(3-fluorophenyl)methyl]-2,4-dimethyl-6-(4-naphthalen-1-ylsulfonylpiperazin-1-yl)pyrimidine Openeye Name: 5-[(3-fluorophenyl)methyl]-2,4-dimethyl-6-[4-(1-naphthylsulfonyl)piperazin-1-yl]pyrimidine CAS Name: 5-[(3-fluorophenyl)methyl]-2,4-dimethyl-6-[4-(1-naphthalenylsulfonyl)-1-piperazinyl]pyrimidine IUPAC Name: 5-[(3-fluorophenyl)methyl]-2,4-dimethyl-6-(4-naphthalen-1-ylsulfonylpiperazin-1-yl)pyrimidine Traditional Name: 5-(3-fluorobenzyl)-2,4-dimethyl-6-[4-(1-naphthylsulfonyl)piperazino]pyrimidine Formula: C27H27FN4O2S MolecularWeight: 490.592283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=CC=CC=C43)CC5=CC(=CC=C5)F

Isomeric SMILES

CC1=C(C(=NC(=N1)C)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=CC=CC=C43)CC5=CC(=CC=C5)F

InChI

InChI=1S/C27H27FN4O2S/c1-19-25(18-21-7-5-10-23(28)17-21)27(30-20(2)29-19)31-13-15-32(16-14-31)35(33,34)26-12-6-9-22-8-3-4-11-24(22)26/h3-12,17H,13-16,18H2,1-2H3