3-methyl-8-[(2E)-2-[(4-methylphenyl)methylidene]hydrazinyl]-7-prop-2-enyl-purine-2,6-dione

Systemtic Name: 3-methyl-8-[(2E)-2-[(4-methylphenyl)methylidene]hydrazinyl]-7-prop-2-enyl-purine-2,6-dione Openeye Name: 7-allyl-3-methyl-8-[(2E)-2-(p-tolylmethylene)hydrazino]purine-2,6-dione CAS Name: 3-methyl-8-[(2E)-2-[(4-methylphenyl)methylidene]hydrazinyl]-7-prop-2-enylpurine-2,6-dione IUPAC Name: 3-methyl-8-[(2E)-2-[(4-methylphenyl)methylidene]hydrazinyl]-7-prop-2-enylpurine-2,6-dione Traditional Name: 7-allyl-3-methyl-8-[(N'E)-N'-(4-methylbenzylidene)hydrazino]xanthine Formula: C17H18N6O2 MolecularWeight: 338.36382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=NNC2=NC3=C(N2CC=C)C(=O)NC(=O)N3C

Isomeric SMILES

CC1=CC=C(C=C1)/C=N/NC2=NC3=C(N2CC=C)C(=O)NC(=O)N3C

InChI

InChI=1S/C17H18N6O2/c1-4-9-23-13-14(22(3)17(25)20-15(13)24)19-16(23)21-18-10-12-7-5-11(2)6-8-12/h4-8,10H,1,9H2,2-3H3,(H,19,21)(H,20,24,25)/b18-10+