4-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-2,6-dimethyl-5-[(4-methylphenyl)methyl]pyrimidine

Systemtic Name: 4-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-2,6-dimethyl-5-[(4-methylphenyl)methyl]pyrimidine Openeye Name: 4-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-2,6-dimethyl-5-(p-tolylmethyl)pyrimidine CAS Name: 4-[4-(4-tert-butylphenyl)sulfonyl-1-piperazinyl]-2,6-dimethyl-5-[(4-methylphenyl)methyl]pyrimidine IUPAC Name: 4-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-2,6-dimethyl-5-[(4-methylphenyl)methyl]pyrimidine Traditional Name: 4-[4-(4-tert-butylphenyl)sulfonylpiperazino]-2,6-dimethyl-5-(4-methylbenzyl)pyrimidine Formula: C28H36N4O2S MolecularWeight: 492.67604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=C(N=C(N=C2N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C(C)(C)C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)CC2=C(N=C(N=C2N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C(C)(C)C)C)C

InChI

InChI=1S/C28H36N4O2S/c1-20-7-9-23(10-8-20)19-26-21(2)29-22(3)30-27(26)31-15-17-32(18-16-31)35(33,34)25-13-11-24(12-14-25)28(4,5)6/h7-14H,15-19H2,1-6H3