2-[2-azanylethyl-[6-[(4-chlorophenyl)methylamino]-9-propan-2-yl-purin-2-yl]amino]ethanol

Systemtic Name: 2-[2-azanylethyl-[6-[(4-chlorophenyl)methylamino]-9-propan-2-yl-purin-2-yl]amino]ethanol Openeye Name: 2-[2-aminoethyl-[6-[(4-chlorophenyl)methylamino]-9-isopropyl-purin-2-yl]amino]ethanol CAS Name: 2-[2-aminoethyl-[6-[(4-chlorophenyl)methylamino]-9-propan-2-yl-2-purinyl]amino]ethanol IUPAC Name: 2-[2-aminoethyl-[6-[(4-chlorophenyl)methylamino]-9-propan-2-ylpurin-2-yl]amino]ethanol Traditional Name: 2-[2-aminoethyl-[6-[(4-chlorobenzyl)amino]-9-isopropyl-purin-2-yl]amino]ethanol Formula: C19H26ClN7O MolecularWeight: 403.90904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)Cl)N(CCN)CCO

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)Cl)N(CCN)CCO

InChI

InChI=1S/C19H26ClN7O/c1-13(2)27-12-23-16-17(22-11-14-3-5-15(20)6-4-14)24-19(25-18(16)27)26(8-7-21)9-10-28/h3-6,12-13,28H,7-11,21H2,1-2H3,(H,22,24,25)