4-(4-ethylsulfonylpiperazin-1-yl)-6-methyl-5-[(2-methylphenyl)methyl]-2-phenyl-pyrimidine

Systemtic Name: 4-(4-ethylsulfonylpiperazin-1-yl)-6-methyl-5-[(2-methylphenyl)methyl]-2-phenyl-pyrimidine Openeye Name: 4-(4-ethylsulfonylpiperazin-1-yl)-6-methyl-5-(o-tolylmethyl)-2-phenyl-pyrimidine CAS Name: 4-(4-ethylsulfonyl-1-piperazinyl)-6-methyl-5-[(2-methylphenyl)methyl]-2-phenylpyrimidine IUPAC Name: 4-(4-ethylsulfonylpiperazin-1-yl)-6-methyl-5-[(2-methylphenyl)methyl]-2-phenylpyrimidine Traditional Name: 4-(4-esylpiperazino)-6-methyl-5-(2-methylbenzyl)-2-phenyl-pyrimidine Formula: C25H30N4O2S MolecularWeight: 450.5963

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCN(CC1)C2=NC(=NC(=C2CC3=CC=CC=C3C)C)C4=CC=CC=C4

Isomeric SMILES

CCS(=O)(=O)N1CCN(CC1)C2=NC(=NC(=C2CC3=CC=CC=C3C)C)C4=CC=CC=C4

InChI

InChI=1S/C25H30N4O2S/c1-4-32(30,31)29-16-14-28(15-17-29)25-23(18-22-13-9-8-10-19(22)2)20(3)26-24(27-25)21-11-6-5-7-12-21/h5-13H,4,14-18H2,1-3H3