1,3-dimethyl-8-[(2E)-2-(phenylmethylidene)hydrazinyl]-7-propyl-purine-2,6-dione

Systemtic Name: 1,3-dimethyl-8-[(2E)-2-(phenylmethylidene)hydrazinyl]-7-propyl-purine-2,6-dione Openeye Name: 8-[(2E)-2-benzylidenehydrazino]-1,3-dimethyl-7-propyl-purine-2,6-dione CAS Name: 1,3-dimethyl-8-[(2E)-2-(phenylmethylene)hydrazinyl]-7-propylpurine-2,6-dione IUPAC Name: 8-[(2E)-2-benzylidenehydrazinyl]-1,3-dimethyl-7-propylpurine-2,6-dione Traditional Name: 8-[(N'E)-N'-benzalhydrazino]-1,3-dimethyl-7-propyl-xanthine Formula: C17H20N6O2 MolecularWeight: 340.3797

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(N=C1NN=CC3=CC=CC=C3)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CCCN1C2=C(N=C1N/N=C/C3=CC=CC=C3)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C17H20N6O2/c1-4-10-23-13-14(21(2)17(25)22(3)15(13)24)19-16(23)20-18-11-12-8-6-5-7-9-12/h5-9,11H,4,10H2,1-3H3,(H,19,20)/b18-11+