8-[(2E)-2-[(4-dimethylaminophenyl)methylidene]hydrazinyl]-7-(2-hydroxyethyl)-3-methyl-purine-2,6-dione

Systemtic Name: 8-[(2E)-2-[(4-dimethylaminophenyl)methylidene]hydrazinyl]-7-(2-hydroxyethyl)-3-methyl-purine-2,6-dione Openeye Name: 8-[(2E)-2-[(4-dimethylaminophenyl)methylene]hydrazino]-7-(2-hydroxyethyl)-3-methyl-purine-2,6-dione CAS Name: 8-[(2E)-2-[(4-dimethylaminophenyl)methylidene]hydrazinyl]-7-(2-hydroxyethyl)-3-methylpurine-2,6-dione IUPAC Name: 8-[(2E)-2-[(4-dimethylaminophenyl)methylidene]hydrazinyl]-7-(2-hydroxyethyl)-3-methylpurine-2,6-dione Traditional Name: 8-[(N'E)-N'-[4-(dimethylamino)benzylidene]hydrazino]-7-(2-hydroxyethyl)-3-methyl-xanthine Formula: C17H21N7O3 MolecularWeight: 371.39374

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C(=N2)NN=CC3=CC=C(C=C3)N(C)C)CCO

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C(=N2)N/N=C/C3=CC=C(C=C3)N(C)C)CCO

InChI

InChI=1S/C17H21N7O3/c1-22(2)12-6-4-11(5-7-12)10-18-21-16-19-14-13(24(16)8-9-25)15(26)20-17(27)23(14)3/h4-7,10,25H,8-9H2,1-3H3,(H,19,21)(H,20,26,27)/b18-10+