(2R)-2-[[6-[(phenylmethyl)amino]-9-propan-2-yl-purin-2-yl]amino]pentan-1-ol

Systemtic Name: (2R)-2-[[6-[(phenylmethyl)amino]-9-propan-2-yl-purin-2-yl]amino]pentan-1-ol Openeye Name: (2R)-2-[[6-(benzylamino)-9-isopropyl-purin-2-yl]amino]pentan-1-ol CAS Name: (2R)-2-[[6-[(phenylmethyl)amino]-9-propan-2-yl-2-purinyl]amino]-1-pentanol IUPAC Name: (2R)-2-[[6-(benzylamino)-9-propan-2-ylpurin-2-yl]amino]pentan-1-ol Traditional Name: (2R)-2-[[6-(benzylamino)-9-isopropyl-purin-2-yl]amino]pentan-1-ol Formula: C20H28N6O MolecularWeight: 368.47592

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CO)NC1=NC2=C(C(=N1)NCC3=CC=CC=C3)N=CN2C(C)C

Isomeric SMILES

CCC[C@H](CO)NC1=NC2=C(C(=N1)NCC3=CC=CC=C3)N=CN2C(C)C

InChI

InChI=1S/C20H28N6O/c1-4-8-16(12-27)23-20-24-18(21-11-15-9-6-5-7-10-15)17-19(25-20)26(13-22-17)14(2)3/h5-7,9-10,13-14,16,27H,4,8,11-12H2,1-3H3,(H2,21,23,24,25)/t16-/m1/s1