8-[(2E)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-7-ethyl-3-methyl-purine-2,6-dione

Systemtic Name: 8-[(2E)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-7-ethyl-3-methyl-purine-2,6-dione Openeye Name: 8-[(2E)-2-[1-(4-chlorophenyl)ethylidene]hydrazino]-7-ethyl-3-methyl-purine-2,6-dione CAS Name: 8-[(2E)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-7-ethyl-3-methylpurine-2,6-dione IUPAC Name: 8-[(2E)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-7-ethyl-3-methylpurine-2,6-dione Traditional Name: 8-[(N'E)-N'-[1-(4-chlorophenyl)ethylidene]hydrazino]-7-ethyl-3-methyl-xanthine Formula: C16H17ClN6O2 MolecularWeight: 360.79818

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(N=C1NN=C(C)C3=CC=C(C=C3)Cl)N(C(=O)NC2=O)C

Isomeric SMILES

CCN1C2=C(N=C1N/N=C(\C)/C3=CC=C(C=C3)Cl)N(C(=O)NC2=O)C

InChI

InChI=1S/C16H17ClN6O2/c1-4-23-12-13(22(3)16(25)19-14(12)24)18-15(23)21-20-9(2)10-5-7-11(17)8-6-10/h5-8H,4H2,1-3H3,(H,18,21)(H,19,24,25)/b20-9+