(2R)-2-[[6-[(3-phenylphenyl)amino]-9-propan-2-yl-purin-2-yl]amino]butan-1-ol

Systemtic Name: (2R)-2-[[6-[(3-phenylphenyl)amino]-9-propan-2-yl-purin-2-yl]amino]butan-1-ol Openeye Name: (2R)-2-[[9-isopropyl-6-(3-phenylanilino)purin-2-yl]amino]butan-1-ol CAS Name: (2R)-2-[[6-(3-phenylanilino)-9-propan-2-yl-2-purinyl]amino]-1-butanol IUPAC Name: (2R)-2-[[6-(3-phenylanilino)-9-propan-2-ylpurin-2-yl]amino]butan-1-ol Traditional Name: (2R)-2-[[9-isopropyl-6-(3-phenylanilino)purin-2-yl]amino]butan-1-ol Formula: C24H28N6O MolecularWeight: 416.51872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC1=NC2=C(C(=N1)NC3=CC=CC(=C3)C4=CC=CC=C4)N=CN2C(C)C

Isomeric SMILES

CC[C@H](CO)NC1=NC2=C(C(=N1)NC3=CC=CC(=C3)C4=CC=CC=C4)N=CN2C(C)C

InChI

InChI=1S/C24H28N6O/c1-4-19(14-31)27-24-28-22(21-23(29-24)30(15-25-21)16(2)3)26-20-12-8-11-18(13-20)17-9-6-5-7-10-17/h5-13,15-16,19,31H,4,14H2,1-3H3,(H2,26,27,28,29)/t19-/m1/s1