4-methyl-6-(4-naphthalen-1-ylsulfonylpiperazin-1-yl)-2-[4-(trifluoromethyl)phenyl]pyrimidine

Systemtic Name: 4-methyl-6-(4-naphthalen-1-ylsulfonylpiperazin-1-yl)-2-[4-(trifluoromethyl)phenyl]pyrimidine Openeye Name: 4-methyl-6-[4-(1-naphthylsulfonyl)piperazin-1-yl]-2-[4-(trifluoromethyl)phenyl]pyrimidine CAS Name: 4-methyl-6-[4-(1-naphthalenylsulfonyl)-1-piperazinyl]-2-[4-(trifluoromethyl)phenyl]pyrimidine IUPAC Name: 4-methyl-6-(4-naphthalen-1-ylsulfonylpiperazin-1-yl)-2-[4-(trifluoromethyl)phenyl]pyrimidine Traditional Name: 4-methyl-6-[4-(1-naphthylsulfonyl)piperazino]-2-[4-(trifluoromethyl)phenyl]pyrimidine Formula: C26H23F3N4O2S MolecularWeight: 512.54663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C2=CC=C(C=C2)C(F)(F)F)N3CCN(CC3)S(=O)(=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

CC1=CC(=NC(=N1)C2=CC=C(C=C2)C(F)(F)F)N3CCN(CC3)S(=O)(=O)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C26H23F3N4O2S/c1-18-17-24(31-25(30-18)20-9-11-21(12-10-20)26(27,28)29)32-13-15-33(16-14-32)36(34,35)23-8-4-6-19-5-2-3-7-22(19)23/h2-12,17H,13-16H2,1H3