1,3-dimethyl-8-[(2E)-2-(1-phenylethylidene)hydrazinyl]-7-prop-2-enyl-purine-2,6-dione

Systemtic Name: 1,3-dimethyl-8-[(2E)-2-(1-phenylethylidene)hydrazinyl]-7-prop-2-enyl-purine-2,6-dione Openeye Name: 7-allyl-1,3-dimethyl-8-[(2E)-2-(1-phenylethylidene)hydrazino]purine-2,6-dione CAS Name: 1,3-dimethyl-8-[(2E)-2-(1-phenylethylidene)hydrazinyl]-7-prop-2-enylpurine-2,6-dione IUPAC Name: 1,3-dimethyl-8-[(2E)-2-(1-phenylethylidene)hydrazinyl]-7-prop-2-enylpurine-2,6-dione Traditional Name: 7-allyl-1,3-dimethyl-8-[(N'E)-N'-(1-phenylethylidene)hydrazino]xanthine Formula: C18H20N6O2 MolecularWeight: 352.3904

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=NC2=C(N1CC=C)C(=O)N(C(=O)N2C)C)C3=CC=CC=C3

Isomeric SMILES

C/C(=N\NC1=NC2=C(N1CC=C)C(=O)N(C(=O)N2C)C)/C3=CC=CC=C3

InChI

InChI=1S/C18H20N6O2/c1-5-11-24-14-15(22(3)18(26)23(4)16(14)25)19-17(24)21-20-12(2)13-9-7-6-8-10-13/h5-10H,1,11H2,2-4H3,(H,19,21)/b20-12+