8-[(2E)-2-[(4-ethoxyphenyl)methylidene]hydrazinyl]-1,3-dimethyl-7-phenethyl-purine-2,6-dione

Systemtic Name: 8-[(2E)-2-[(4-ethoxyphenyl)methylidene]hydrazinyl]-1,3-dimethyl-7-phenethyl-purine-2,6-dione Openeye Name: 8-[(2E)-2-[(4-ethoxyphenyl)methylene]hydrazino]-1,3-dimethyl-7-phenethyl-purine-2,6-dione CAS Name: 8-[(2E)-2-[(4-ethoxyphenyl)methylidene]hydrazinyl]-1,3-dimethyl-7-phenethylpurine-2,6-dione IUPAC Name: 8-[(2E)-2-[(4-ethoxyphenyl)methylidene]hydrazinyl]-1,3-dimethyl-7-phenethylpurine-2,6-dione Traditional Name: 8-[(N'E)-N'-(4-ethoxybenzylidene)hydrazino]-1,3-dimethyl-7-phenethyl-xanthine Formula: C24H26N6O3 MolecularWeight: 446.50164

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=NNC2=NC3=C(N2CCC4=CC=CC=C4)C(=O)N(C(=O)N3C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)/C=N/NC2=NC3=C(N2CCC4=CC=CC=C4)C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C24H26N6O3/c1-4-33-19-12-10-18(11-13-19)16-25-27-23-26-21-20(22(31)29(3)24(32)28(21)2)30(23)15-14-17-8-6-5-7-9-17/h5-13,16H,4,14-15H2,1-3H3,(H,26,27)/b25-16+