4-methyl-6-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-5-propan-2-yl-2-[4-(trifluoromethyl)phenyl]pyrimidine

Systemtic Name: 4-methyl-6-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-5-propan-2-yl-2-[4-(trifluoromethyl)phenyl]pyrimidine Openeye Name: 5-isopropyl-4-methyl-6-[4-(2-naphthylsulfonyl)piperazin-1-yl]-2-[4-(trifluoromethyl)phenyl]pyrimidine CAS Name: 4-methyl-6-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]-5-propan-2-yl-2-[4-(trifluoromethyl)phenyl]pyrimidine IUPAC Name: 4-methyl-6-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-5-propan-2-yl-2-[4-(trifluoromethyl)phenyl]pyrimidine Traditional Name: 5-isopropyl-4-methyl-6-[4-(2-naphthylsulfonyl)piperazino]-2-[4-(trifluoromethyl)phenyl]pyrimidine Formula: C29H29F3N4O2S MolecularWeight: 554.62637

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2=CC=C(C=C2)C(F)(F)F)N3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4)C(C)C

Isomeric SMILES

CC1=C(C(=NC(=N1)C2=CC=C(C=C2)C(F)(F)F)N3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4)C(C)C

InChI

InChI=1S/C29H29F3N4O2S/c1-19(2)26-20(3)33-27(22-8-11-24(12-9-22)29(30,31)32)34-28(26)35-14-16-36(17-15-35)39(37,38)25-13-10-21-6-4-5-7-23(21)18-25/h4-13,18-19H,14-17H2,1-3H3