7-methyl-6-[(2-oxidanyl-2-phenyl-ethyl)amino]-3-propyl-purin-2-one

Systemtic Name: 7-methyl-6-[(2-oxidanyl-2-phenyl-ethyl)amino]-3-propyl-purin-2-one Openeye Name: 6-[(2-hydroxy-2-phenyl-ethyl)amino]-7-methyl-3-propyl-purin-2-one CAS Name: 6-[(2-hydroxy-2-phenylethyl)amino]-7-methyl-3-propyl-2-purinone IUPAC Name: 6-[(2-hydroxy-2-phenylethyl)amino]-7-methyl-3-propylpurin-2-one Traditional Name: 6-[(2-hydroxy-2-phenyl-ethyl)amino]-7-methyl-3-propyl-purin-2-one Formula: C17H21N5O2 MolecularWeight: 327.38094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=NC1=O)NCC(C3=CC=CC=C3)O)N(C=N2)C

Isomeric SMILES

CCCN1C2=C(C(=NC1=O)NCC(C3=CC=CC=C3)O)N(C=N2)C

InChI

InChI=1S/C17H21N5O2/c1-3-9-22-16-14(21(2)11-19-16)15(20-17(22)24)18-10-13(23)12-7-5-4-6-8-12/h4-8,11,13,23H,3,9-10H2,1-2H3,(H,18,20,24)