2-azanyl-8-(1-benzofuran-2-ylmethyl)-3,7-dihydropurin-6-one

Systemtic Name: 2-azanyl-8-(1-benzofuran-2-ylmethyl)-3,7-dihydropurin-6-one Openeye Name: 2-amino-8-(benzofuran-2-ylmethyl)-3,7-dihydropurin-6-one CAS Name: 2-amino-8-(2-benzofuranylmethyl)-3,7-dihydropurin-6-one IUPAC Name: 2-amino-8-(1-benzofuran-2-ylmethyl)-3,7-dihydropurin-6-one Traditional Name: 2-amino-8-(benzofuran-2-ylmethyl)-3,7-dihydropurin-6-one Formula: C14H11N5O2 MolecularWeight: 281.26944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(O2)CC3=NC4=C(N3)C(=O)N=C(N4)N

Isomeric SMILES

C1=CC=C2C(=C1)C=C(O2)CC3=NC4=C(N3)C(=O)N=C(N4)N

InChI

InChI=1S/C14H11N5O2/c15-14-18-12-11(13(20)19-14)16-10(17-12)6-8-5-7-3-1-2-4-9(7)21-8/h1-5H,6H2,(H4,15,16,17,18,19,20)