3-[6-[3-(2-azanylethyl)phenoxy]-8,9-diethyl-purin-2-yl]oxy-4-chloranyl-benzenecarboximidamide

Systemtic Name: 3-[6-[3-(2-azanylethyl)phenoxy]-8,9-diethyl-purin-2-yl]oxy-4-chloranyl-benzenecarboximidamide Openeye Name: 3-[6-[3-(2-aminoethyl)phenoxy]-8,9-diethyl-purin-2-yl]oxy-4-chloro-benzamidine CAS Name: 3-[[6-[3-(2-aminoethyl)phenoxy]-8,9-diethyl-2-purinyl]oxy]-4-chlorobenzenecarboximidamide IUPAC Name: 3-[6-[3-(2-aminoethyl)phenoxy]-8,9-diethylpurin-2-yl]oxy-4-chlorobenzenecarboximidamide Traditional Name: 3-[6-[3-(2-aminoethyl)phenoxy]-8,9-diethyl-purin-2-yl]oxy-4-chloro-benzamidine Formula: C24H26ClN7O2 MolecularWeight: 479.96194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1CC)N=C(N=C2OC3=CC=CC(=C3)CCN)OC4=C(C=CC(=C4)C(=N)N)Cl

Isomeric SMILES

CCC1=NC2=C(N1CC)N=C(N=C2OC3=CC=CC(=C3)CCN)OC4=C(C=CC(=C4)C(=N)N)Cl

InChI

InChI=1S/C24H26ClN7O2/c1-3-19-29-20-22(32(19)4-2)30-24(34-18-13-15(21(27)28)8-9-17(18)25)31-23(20)33-16-7-5-6-14(12-16)10-11-26/h5-9,12-13H,3-4,10-11,26H2,1-2H3,(H3,27,28)