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

Systemtic Name: 4-(methoxymethyl)-5-[(3-methylphenyl)methyl]-6-(4-methylsulfonylpiperazin-1-yl)-2-phenyl-pyrimidine Openeye Name: 4-(methoxymethyl)-6-(4-methylsulfonylpiperazin-1-yl)-5-(m-tolylmethyl)-2-phenyl-pyrimidine CAS Name: 4-(methoxymethyl)-5-[(3-methylphenyl)methyl]-6-(4-methylsulfonyl-1-piperazinyl)-2-phenylpyrimidine IUPAC Name: 4-(methoxymethyl)-5-[(3-methylphenyl)methyl]-6-(4-methylsulfonylpiperazin-1-yl)-2-phenylpyrimidine Traditional Name: 4-(4-mesylpiperazino)-6-(methoxymethyl)-5-(3-methylbenzyl)-2-phenyl-pyrimidine Formula: C25H30N4O3S MolecularWeight: 466.5957

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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