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

Systemtic Name: 7-[(4-chlorophenyl)methyl]-8-[(2Z)-2-[1-(4-methoxyphenyl)ethylidene]hydrazinyl]-3-methyl-purine-2,6-dione Openeye Name: 7-[(4-chlorophenyl)methyl]-8-[(2Z)-2-[1-(4-methoxyphenyl)ethylidene]hydrazino]-3-methyl-purine-2,6-dione CAS Name: 7-[(4-chlorophenyl)methyl]-8-[(2Z)-2-[1-(4-methoxyphenyl)ethylidene]hydrazinyl]-3-methylpurine-2,6-dione IUPAC Name: 7-[(4-chlorophenyl)methyl]-8-[(2Z)-2-[1-(4-methoxyphenyl)ethylidene]hydrazinyl]-3-methylpurine-2,6-dione Traditional Name: 7-(4-chlorobenzyl)-8-[(N'Z)-N'-[1-(4-methoxyphenyl)ethylidene]hydrazino]-3-methyl-xanthine Formula: C22H21ClN6O3 MolecularWeight: 452.89354

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=NC2=C(N1CC3=CC=C(C=C3)Cl)C(=O)NC(=O)N2C)C4=CC=C(C=C4)OC

Isomeric SMILES

C/C(=N/NC1=NC2=C(N1CC3=CC=C(C=C3)Cl)C(=O)NC(=O)N2C)/C4=CC=C(C=C4)OC

InChI

InChI=1S/C22H21ClN6O3/c1-13(15-6-10-17(32-3)11-7-15)26-27-21-24-19-18(20(30)25-22(31)28(19)2)29(21)12-14-4-8-16(23)9-5-14/h4-11H,12H2,1-3H3,(H,24,27)(H,25,30,31)/b26-13-