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

Systemtic Name: 5-[(3-chlorophenyl)methyl]-4-ethyl-6-(4-methylsulfonylpiperazin-1-yl)-2-phenyl-pyrimidine Openeye Name: 5-[(3-chlorophenyl)methyl]-4-ethyl-6-(4-methylsulfonylpiperazin-1-yl)-2-phenyl-pyrimidine CAS Name: 5-[(3-chlorophenyl)methyl]-4-ethyl-6-(4-methylsulfonyl-1-piperazinyl)-2-phenylpyrimidine IUPAC Name: 5-[(3-chlorophenyl)methyl]-4-ethyl-6-(4-methylsulfonylpiperazin-1-yl)-2-phenylpyrimidine Traditional Name: 5-(3-chlorobenzyl)-4-ethyl-6-(4-mesylpiperazino)-2-phenyl-pyrimidine Formula: C24H27ClN4O2S MolecularWeight: 471.01478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)C2=CC=CC=C2)N3CCN(CC3)S(=O)(=O)C)CC4=CC(=CC=C4)Cl

Isomeric SMILES

CCC1=C(C(=NC(=N1)C2=CC=CC=C2)N3CCN(CC3)S(=O)(=O)C)CC4=CC(=CC=C4)Cl

InChI

InChI=1S/C24H27ClN4O2S/c1-3-22-21(17-18-8-7-11-20(25)16-18)24(27-23(26-22)19-9-5-4-6-10-19)28-12-14-29(15-13-28)32(2,30)31/h4-11,16H,3,12-15,17H2,1-2H3