4-ethyl-5-[(3-methylphenyl)methyl]-2-phenyl-6-(4-propylsulfonylpiperazin-1-yl)pyrimidine

Systemtic Name: 4-ethyl-5-[(3-methylphenyl)methyl]-2-phenyl-6-(4-propylsulfonylpiperazin-1-yl)pyrimidine Openeye Name: 4-ethyl-5-(m-tolylmethyl)-2-phenyl-6-(4-propylsulfonylpiperazin-1-yl)pyrimidine CAS Name: 4-ethyl-5-[(3-methylphenyl)methyl]-2-phenyl-6-(4-propylsulfonyl-1-piperazinyl)pyrimidine IUPAC Name: 4-ethyl-5-[(3-methylphenyl)methyl]-2-phenyl-6-(4-propylsulfonylpiperazin-1-yl)pyrimidine Traditional Name: 4-ethyl-5-(3-methylbenzyl)-2-phenyl-6-(4-propylsulfonylpiperazino)pyrimidine Formula: C27H34N4O2S MolecularWeight: 478.64946

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCN(CC1)C2=NC(=NC(=C2CC3=CC=CC(=C3)C)CC)C4=CC=CC=C4

Isomeric SMILES

CCCS(=O)(=O)N1CCN(CC1)C2=NC(=NC(=C2CC3=CC=CC(=C3)C)CC)C4=CC=CC=C4

InChI

InChI=1S/C27H34N4O2S/c1-4-18-34(32,33)31-16-14-30(15-17-31)27-24(20-22-11-9-10-21(3)19-22)25(5-2)28-26(29-27)23-12-7-6-8-13-23/h6-13,19H,4-5,14-18,20H2,1-3H3