7,9-dimethyl-3-thiophen-2-yl-1,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-dione

Systemtic Name: 7,9-dimethyl-3-thiophen-2-yl-1,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-dione Openeye Name: 7,9-dimethyl-3-(2-thienyl)-1,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-dione CAS Name: 7,9-dimethyl-3-thiophen-2-yl-1,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-dione IUPAC Name: 7,9-dimethyl-3-thiophen-2-yl-1,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-dione Traditional Name: 7,9-dimethyl-3-(2-thienyl)-1,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-quinone Formula: C13H12N6O2S MolecularWeight: 316.33838

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N3CC(=NNC3=N2)C4=CC=CS4

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N3CC(=NNC3=N2)C4=CC=CS4

InChI

InChI=1S/C13H12N6O2S/c1-17-10-9(11(20)18(2)13(17)21)19-6-7(8-4-3-5-22-8)15-16-12(19)14-10/h3-5H,6H2,1-2H3,(H,14,16)