2-[(4-bromanylthiophen-2-yl)methylamino]-7,9-dihydro-3H-purine-6,8-dione

Systemtic Name: 2-[(4-bromanylthiophen-2-yl)methylamino]-7,9-dihydro-3H-purine-6,8-dione Openeye Name: 2-[(4-bromo-2-thienyl)methylamino]-7,9-dihydro-3H-purine-6,8-dione CAS Name: 2-[(4-bromo-2-thiophenyl)methylamino]-7,9-dihydro-3H-purine-6,8-dione IUPAC Name: 2-[(4-bromothiophen-2-yl)methylamino]-7,9-dihydro-3H-purine-6,8-dione Traditional Name: 2-[(4-bromo-2-thienyl)methylamino]-7,9-dihydro-3H-purine-6,8-quinone Formula: C10H8BrN5O2S MolecularWeight: 342.17182

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC=C1Br)CNC2=NC(=O)C3=C(N2)NC(=O)N3

Isomeric SMILES

C1=C(SC=C1Br)CNC2=NC(=O)C3=C(N2)NC(=O)N3

InChI

InChI=1S/C10H8BrN5O2S/c11-4-1-5(19-3-4)2-12-9-14-7-6(8(17)16-9)13-10(18)15-7/h1,3H,2H2,(H4,12,13,14,15,16,17,18)