7-hexyl-8-[(2Z)-2-[(4-methoxyphenyl)methylidene]hydrazinyl]-3-methyl-purine-2,6-dione

Systemtic Name: 7-hexyl-8-[(2Z)-2-[(4-methoxyphenyl)methylidene]hydrazinyl]-3-methyl-purine-2,6-dione Openeye Name: 7-hexyl-8-[(2Z)-2-[(4-methoxyphenyl)methylene]hydrazino]-3-methyl-purine-2,6-dione CAS Name: 7-hexyl-8-[(2Z)-2-[(4-methoxyphenyl)methylidene]hydrazinyl]-3-methylpurine-2,6-dione IUPAC Name: 7-hexyl-8-[(2Z)-2-[(4-methoxyphenyl)methylidene]hydrazinyl]-3-methylpurine-2,6-dione Traditional Name: 7-hexyl-3-methyl-8-[(N'Z)-N'-p-anisylidenehydrazino]xanthine Formula: C20H26N6O3 MolecularWeight: 398.45884

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=C(N=C1NN=CC3=CC=C(C=C3)OC)N(C(=O)NC2=O)C

Isomeric SMILES

CCCCCCN1C2=C(N=C1N/N=C\C3=CC=C(C=C3)OC)N(C(=O)NC2=O)C

InChI

InChI=1S/C20H26N6O3/c1-4-5-6-7-12-26-16-17(25(2)20(28)23-18(16)27)22-19(26)24-21-13-14-8-10-15(29-3)11-9-14/h8-11,13H,4-7,12H2,1-3H3,(H,22,24)(H,23,27,28)/b21-13-