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

Systemtic Name: 4-(methoxymethyl)-5-[(4-methylphenyl)methyl]-6-(4-methylsulfonylpiperazin-1-yl)-2-phenyl-pyrimidine Openeye Name: 4-(methoxymethyl)-6-(4-methylsulfonylpiperazin-1-yl)-2-phenyl-5-(p-tolylmethyl)pyrimidine CAS Name: 4-(methoxymethyl)-5-[(4-methylphenyl)methyl]-6-(4-methylsulfonyl-1-piperazinyl)-2-phenylpyrimidine IUPAC Name: 4-(methoxymethyl)-5-[(4-methylphenyl)methyl]-6-(4-methylsulfonylpiperazin-1-yl)-2-phenylpyrimidine Traditional Name: 4-(4-mesylpiperazino)-6-(methoxymethyl)-5-(4-methylbenzyl)-2-phenyl-pyrimidine Formula: C25H30N4O3S MolecularWeight: 466.5957

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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)C)C4=CC=CC=C4)COC

Isomeric SMILES

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

InChI

InChI=1S/C25H30N4O3S/c1-19-9-11-20(12-10-19)17-22-23(18-32-2)26-24(21-7-5-4-6-8-21)27-25(22)28-13-15-29(16-14-28)33(3,30)31/h4-12H,13-18H2,1-3H3