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

Systemtic Name: 4-methyl-6-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-phenyl-5-propan-2-yl-pyrimidine Openeye Name: 5-isopropyl-4-methyl-6-[4-(2-naphthylsulfonyl)piperazin-1-yl]-2-phenyl-pyrimidine CAS Name: 4-methyl-6-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]-2-phenyl-5-propan-2-ylpyrimidine IUPAC Name: 4-methyl-6-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-phenyl-5-propan-2-ylpyrimidine Traditional Name: 5-isopropyl-4-methyl-6-[4-(2-naphthylsulfonyl)piperazino]-2-phenyl-pyrimidine Formula: C28H30N4O2S MolecularWeight: 486.6284

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H30N4O2S/c1-20(2)26-21(3)29-27(23-10-5-4-6-11-23)30-28(26)31-15-17-32(18-16-31)35(33,34)25-14-13-22-9-7-8-12-24(22)19-25/h4-14,19-20H,15-18H2,1-3H3