8-[(2E)-2-[(4-fluorophenyl)methylidene]hydrazinyl]-3-methyl-7-propan-2-yl-purine-2,6-dione

Systemtic Name: 8-[(2E)-2-[(4-fluorophenyl)methylidene]hydrazinyl]-3-methyl-7-propan-2-yl-purine-2,6-dione Openeye Name: 8-[(2E)-2-[(4-fluorophenyl)methylene]hydrazino]-7-isopropyl-3-methyl-purine-2,6-dione CAS Name: 8-[(2E)-2-[(4-fluorophenyl)methylidene]hydrazinyl]-3-methyl-7-propan-2-ylpurine-2,6-dione IUPAC Name: 8-[(2E)-2-[(4-fluorophenyl)methylidene]hydrazinyl]-3-methyl-7-propan-2-ylpurine-2,6-dione Traditional Name: 8-[(N'E)-N'-(4-fluorobenzylidene)hydrazino]-7-isopropyl-3-methyl-xanthine Formula: C16H17FN6O2 MolecularWeight: 344.343583

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(N=C1NN=CC3=CC=C(C=C3)F)N(C(=O)NC2=O)C

Isomeric SMILES

CC(C)N1C2=C(N=C1N/N=C/C3=CC=C(C=C3)F)N(C(=O)NC2=O)C

InChI

InChI=1S/C16H17FN6O2/c1-9(2)23-12-13(22(3)16(25)20-14(12)24)19-15(23)21-18-8-10-4-6-11(17)7-5-10/h4-9H,1-3H3,(H,19,21)(H,20,24,25)/b18-8+