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

Systemtic Name: 7-butyl-8-[(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-3-methyl-purine-2,6-dione Openeye Name: 7-butyl-8-[(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazino]-3-methyl-purine-2,6-dione CAS Name: 7-butyl-8-[(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-3-methylpurine-2,6-dione IUPAC Name: 7-butyl-8-[(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-3-methylpurine-2,6-dione Traditional Name: 7-butyl-8-[(N'Z)-N'-[1-(4-chlorophenyl)ethylidene]hydrazino]-3-methyl-xanthine Formula: C18H21ClN6O2 MolecularWeight: 388.85134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(N=C1NN=C(C)C3=CC=C(C=C3)Cl)N(C(=O)NC2=O)C

Isomeric SMILES

CCCCN1C2=C(N=C1N/N=C(/C)\C3=CC=C(C=C3)Cl)N(C(=O)NC2=O)C

InChI

InChI=1S/C18H21ClN6O2/c1-4-5-10-25-14-15(24(3)18(27)21-16(14)26)20-17(25)23-22-11(2)12-6-8-13(19)9-7-12/h6-9H,4-5,10H2,1-3H3,(H,20,23)(H,21,26,27)/b22-11-