2-[[6-[(phenylmethyl)amino]-9-propan-2-yl-8H-purin-7-yl]amino]butan-1-ol

Systemtic Name: 2-[[6-[(phenylmethyl)amino]-9-propan-2-yl-8H-purin-7-yl]amino]butan-1-ol Openeye Name: 2-[[6-(benzylamino)-9-isopropyl-8H-purin-7-yl]amino]butan-1-ol CAS Name: 2-[[6-[(phenylmethyl)amino]-9-propan-2-yl-8H-purin-7-yl]amino]-1-butanol IUPAC Name: 2-[[6-(benzylamino)-9-propan-2-yl-8H-purin-7-yl]amino]butan-1-ol Traditional Name: 2-[[6-(benzylamino)-9-isopropyl-8H-purin-7-yl]amino]butan-1-ol Formula: C19H28N6O MolecularWeight: 356.46522

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NN1CN(C2=C1C(=NC=N2)NCC3=CC=CC=C3)C(C)C

Isomeric SMILES

CCC(CO)NN1CN(C2=C1C(=NC=N2)NCC3=CC=CC=C3)C(C)C

InChI

InChI=1S/C19H28N6O/c1-4-16(11-26)23-25-13-24(14(2)3)19-17(25)18(21-12-22-19)20-10-15-8-6-5-7-9-15/h5-9,12,14,16,23,26H,4,10-11,13H2,1-3H3,(H,20,21,22)