N-[(5-methylfuran-2-yl)methyl]-3-(6-phenylmethoxypurin-9-yl)propan-1-amine

Systemtic Name: N-[(5-methylfuran-2-yl)methyl]-3-(6-phenylmethoxypurin-9-yl)propan-1-amine Openeye Name: 3-(6-benzyloxypurin-9-yl)-N-[(5-methyl-2-furyl)methyl]propan-1-amine CAS Name: N-[(5-methyl-2-furanyl)methyl]-3-(6-phenylmethoxy-9-purinyl)-1-propanamine IUPAC Name: N-[(5-methylfuran-2-yl)methyl]-3-(6-phenylmethoxypurin-9-yl)propan-1-amine Traditional Name: 3-(6-benzoxypurin-9-yl)propyl-[(5-methyl-2-furyl)methyl]amine Formula: C21H23N5O2 MolecularWeight: 377.43962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CNCCCN2C=NC3=C2N=CN=C3OCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(O1)CNCCCN2C=NC3=C2N=CN=C3OCC4=CC=CC=C4

InChI

InChI=1S/C21H23N5O2/c1-16-8-9-18(28-16)12-22-10-5-11-26-15-25-19-20(26)23-14-24-21(19)27-13-17-6-3-2-4-7-17/h2-4,6-9,14-15,22H,5,10-13H2,1H3