4-methyl-2-(3-methylphenyl)-6-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-5-propan-2-yl-pyrimidine

Systemtic Name: 4-methyl-2-(3-methylphenyl)-6-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-5-propan-2-yl-pyrimidine Openeye Name: 5-isopropyl-4-methyl-2-(m-tolyl)-6-[4-(2-naphthylsulfonyl)piperazin-1-yl]pyrimidine CAS Name: 4-methyl-2-(3-methylphenyl)-6-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]-5-propan-2-ylpyrimidine IUPAC Name: 4-methyl-2-(3-methylphenyl)-6-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-5-propan-2-ylpyrimidine Traditional Name: 5-isopropyl-4-methyl-2-(m-tolyl)-6-[4-(2-naphthylsulfonyl)piperazino]pyrimidine Formula: C29H32N4O2S MolecularWeight: 500.65498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=C(C(=N2)N3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4)C(C)C)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC(=C(C(=N2)N3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4)C(C)C)C

InChI

InChI=1S/C29H32N4O2S/c1-20(2)27-22(4)30-28(25-11-7-8-21(3)18-25)31-29(27)32-14-16-33(17-15-32)36(34,35)26-13-12-23-9-5-6-10-24(23)19-26/h5-13,18-20H,14-17H2,1-4H3