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

Systemtic Name: 8-[2-[(4-dimethylaminophenyl)methylidene]hydrazinyl]-3-methyl-7-pentyl-purine-2,6-dione Openeye Name: 8-[2-[(4-dimethylaminophenyl)methylene]hydrazino]-3-methyl-7-pentyl-purine-2,6-dione CAS Name: 8-[2-[(4-dimethylaminophenyl)methylidene]hydrazinyl]-3-methyl-7-pentylpurine-2,6-dione IUPAC Name: 8-[2-[(4-dimethylaminophenyl)methylidene]hydrazinyl]-3-methyl-7-pentylpurine-2,6-dione Traditional Name: 7-amyl-8-[N'-[4-(dimethylamino)benzylidene]hydrazino]-3-methyl-xanthine Formula: C20H27N7O2 MolecularWeight: 397.47408

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=C(N=C1NN=CC3=CC=C(C=C3)N(C)C)N(C(=O)NC2=O)C

Isomeric SMILES

CCCCCN1C2=C(N=C1NN=CC3=CC=C(C=C3)N(C)C)N(C(=O)NC2=O)C

InChI

InChI=1S/C20H27N7O2/c1-5-6-7-12-27-16-17(26(4)20(29)23-18(16)28)22-19(27)24-21-13-14-8-10-15(11-9-14)25(2)3/h8-11,13H,5-7,12H2,1-4H3,(H,22,24)(H,23,28,29)