5-[(2,5-dimethylphenyl)methyl]-4-ethyl-6-(4-ethylsulfonylpiperazin-1-yl)-2-methyl-pyrimidine

Systemtic Name: 5-[(2,5-dimethylphenyl)methyl]-4-ethyl-6-(4-ethylsulfonylpiperazin-1-yl)-2-methyl-pyrimidine Openeye Name: 5-[(2,5-dimethylphenyl)methyl]-4-ethyl-6-(4-ethylsulfonylpiperazin-1-yl)-2-methyl-pyrimidine CAS Name: 5-[(2,5-dimethylphenyl)methyl]-4-ethyl-6-(4-ethylsulfonyl-1-piperazinyl)-2-methylpyrimidine IUPAC Name: 5-[(2,5-dimethylphenyl)methyl]-4-ethyl-6-(4-ethylsulfonylpiperazin-1-yl)-2-methylpyrimidine Traditional Name: 5-(2,5-dimethylbenzyl)-4-(4-esylpiperazino)-6-ethyl-2-methyl-pyrimidine Formula: C22H32N4O2S MolecularWeight: 416.58008

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)C)N2CCN(CC2)S(=O)(=O)CC)CC3=C(C=CC(=C3)C)C

Isomeric SMILES

CCC1=C(C(=NC(=N1)C)N2CCN(CC2)S(=O)(=O)CC)CC3=C(C=CC(=C3)C)C

InChI

InChI=1S/C22H32N4O2S/c1-6-21-20(15-19-14-16(3)8-9-17(19)4)22(24-18(5)23-21)25-10-12-26(13-11-25)29(27,28)7-2/h8-9,14H,6-7,10-13,15H2,1-5H3