2-[[6-[(phenylmethyl)amino]-9-propan-2-yl-purin-2-yl]amino]ethanol

Systemtic Name: 2-[[6-[(phenylmethyl)amino]-9-propan-2-yl-purin-2-yl]amino]ethanol Openeye Name: 2-[[6-(benzylamino)-9-isopropyl-purin-2-yl]amino]ethanol CAS Name: 2-[[6-[(phenylmethyl)amino]-9-propan-2-yl-2-purinyl]amino]ethanol IUPAC Name: 2-[[6-(benzylamino)-9-propan-2-ylpurin-2-yl]amino]ethanol Traditional Name: 2-[[6-(benzylamino)-9-isopropyl-purin-2-yl]amino]ethanol Formula: C17H22N6O MolecularWeight: 326.39618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=CC=C3)NCCO

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=CC=C3)NCCO

InChI

InChI=1S/C17H22N6O/c1-12(2)23-11-20-14-15(19-10-13-6-4-3-5-7-13)21-17(18-8-9-24)22-16(14)23/h3-7,11-12,24H,8-10H2,1-2H3,(H2,18,19,21,22)