[2-azanyl-4-oxidanylidene-5-(4-phenylbutyl)-1H-pyrimidin-6-yl]methyl-triphenyl-phosphanium

Systemtic Name: [2-azanyl-4-oxidanylidene-5-(4-phenylbutyl)-1H-pyrimidin-6-yl]methyl-triphenyl-phosphanium Openeye Name: [2-amino-4-oxo-5-(4-phenylbutyl)-1H-pyrimidin-6-yl]methyl-triphenyl-phosphonium CAS Name: [2-amino-4-oxo-5-(4-phenylbutyl)-1H-pyrimidin-6-yl]methyl-triphenylphosphonium IUPAC Name: [2-amino-4-oxo-5-(4-phenylbutyl)-1H-pyrimidin-6-yl]methyl-triphenylphosphanium Traditional Name: [2-amino-4-keto-5-(4-phenylbutyl)-1H-pyrimidin-6-yl]methyl-triphenyl-phosphonium Formula: C33H33N3OP+ MolecularWeight: 518.608381

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCC2=C(NC(=NC2=O)N)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CCCCC2=C(NC(=NC2=O)N)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C33H32N3OP/c34-33-35-31(30(32(37)36-33)24-14-13-17-26-15-5-1-6-16-26)25-38(27-18-7-2-8-19-27,28-20-9-3-10-21-28)29-22-11-4-12-23-29/h1-12,15-16,18-23H,13-14,17,24-25H2,(H2-,34,35,36,37)/p+1