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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(N=C1NN=CC3=CC=C(C=C3)Cl)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CCCCN1C2=C(N=C1N/N=C\C3=CC=C(C=C3)Cl)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C18H21ClN6O2/c1-4-5-10-25-14-15(23(2)18(27)24(3)16(14)26)21-17(25)22-20-11-12-6-8-13(19)9-7-12/h6-9,11H,4-5,10H2,1-3H3,(H,21,22)/b20-11-