3-[[[2-[hydroxymethyl(propyl)amino]-9-propan-2-yl-purin-6-yl]amino]methyl]phenol

Systemtic Name: 3-[[[2-[hydroxymethyl(propyl)amino]-9-propan-2-yl-purin-6-yl]amino]methyl]phenol Openeye Name: 3-[[[2-[hydroxymethyl(propyl)amino]-9-isopropyl-purin-6-yl]amino]methyl]phenol CAS Name: 3-[[[2-[hydroxymethyl(propyl)amino]-9-propan-2-yl-6-purinyl]amino]methyl]phenol IUPAC Name: 3-[[[2-[hydroxymethyl(propyl)amino]-9-propan-2-ylpurin-6-yl]amino]methyl]phenol Traditional Name: 3-[[[9-isopropyl-2-[methylol(propyl)amino]purin-6-yl]amino]methyl]phenol Formula: C19H26N6O2 MolecularWeight: 370.44874

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CO)C1=NC2=C(C(=N1)NCC3=CC(=CC=C3)O)N=CN2C(C)C

Isomeric SMILES

CCCN(CO)C1=NC2=C(C(=N1)NCC3=CC(=CC=C3)O)N=CN2C(C)C

InChI

InChI=1S/C19H26N6O2/c1-4-8-24(12-26)19-22-17(20-10-14-6-5-7-15(27)9-14)16-18(23-19)25(11-21-16)13(2)3/h5-7,9,11,13,26-27H,4,8,10,12H2,1-3H3,(H,20,22,23)