4-[4-(2-diphenylphosphorylethyl)piperazin-1-yl]-6-methyl-2-propan-2-yl-pyrimidine

Systemtic Name: 4-[4-(2-diphenylphosphorylethyl)piperazin-1-yl]-6-methyl-2-propan-2-yl-pyrimidine Openeye Name: 4-[4-(2-diphenylphosphorylethyl)piperazin-1-yl]-2-isopropyl-6-methyl-pyrimidine CAS Name: 4-[4-(2-diphenylphosphorylethyl)-1-piperazinyl]-6-methyl-2-propan-2-ylpyrimidine IUPAC Name: 4-[4-(2-diphenylphosphorylethyl)piperazin-1-yl]-6-methyl-2-propan-2-ylpyrimidine Traditional Name: 4-[4-(2-diphenylphosphorylethyl)piperazino]-2-isopropyl-6-methyl-pyrimidine Formula: C26H33N4OP MolecularWeight: 448.540181

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)CCP(=O)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)CCP(=O)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H33N4OP/c1-21(2)26-27-22(3)20-25(28-26)30-16-14-29(15-17-30)18-19-32(31,23-10-6-4-7-11-23)24-12-8-5-9-13-24/h4-13,20-21H,14-19H2,1-3H3