7,9-dimethyl-3-phenyl-1-prop-2-enyl-4H-purino[8,7-c][1,2,4]triazine-6,8-dione

Systemtic Name: 7,9-dimethyl-3-phenyl-1-prop-2-enyl-4H-purino[8,7-c][1,2,4]triazine-6,8-dione Openeye Name: 1-allyl-7,9-dimethyl-3-phenyl-4H-purino[8,7-c][1,2,4]triazine-6,8-dione CAS Name: 7,9-dimethyl-3-phenyl-1-prop-2-enyl-4H-purino[8,7-c][1,2,4]triazine-6,8-dione IUPAC Name: 7,9-dimethyl-3-phenyl-1-prop-2-enyl-4H-purino[8,7-c][1,2,4]triazine-6,8-dione Traditional Name: 1-allyl-7,9-dimethyl-3-phenyl-4H-purino[8,7-c][1,2,4]triazine-6,8-quinone Formula: C18H18N6O2 MolecularWeight: 350.37452

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N3CC(=NN(C3=N2)CC=C)C4=CC=CC=C4

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N3CC(=NN(C3=N2)CC=C)C4=CC=CC=C4

InChI

InChI=1S/C18H18N6O2/c1-4-10-24-17-19-15-14(16(25)22(3)18(26)21(15)2)23(17)11-13(20-24)12-8-6-5-7-9-12/h4-9H,1,10-11H2,2-3H3