2-azanyl-8-[(5-bromanylthiophen-2-yl)methyl]-3,7-dihydropurin-6-one

Systemtic Name: 2-azanyl-8-[(5-bromanylthiophen-2-yl)methyl]-3,7-dihydropurin-6-one Openeye Name: 2-amino-8-[(5-bromo-2-thienyl)methyl]-3,7-dihydropurin-6-one CAS Name: 2-amino-8-[(5-bromo-2-thiophenyl)methyl]-3,7-dihydropurin-6-one IUPAC Name: 2-amino-8-[(5-bromothiophen-2-yl)methyl]-3,7-dihydropurin-6-one Traditional Name: 2-amino-8-[(5-bromo-2-thienyl)methyl]-3,7-dihydropurin-6-one Formula: C10H8BrN5OS MolecularWeight: 326.17242

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1)Br)CC2=NC3=C(N2)C(=O)N=C(N3)N

Isomeric SMILES

C1=C(SC(=C1)Br)CC2=NC3=C(N2)C(=O)N=C(N3)N

InChI

InChI=1S/C10H8BrN5OS/c11-5-2-1-4(18-5)3-6-13-7-8(14-6)15-10(12)16-9(7)17/h1-2H,3H2,(H4,12,13,14,15,16,17)