8-[(2E)-2-[(4-bromophenyl)methylidene]hydrazinyl]-7-decyl-3-methyl-purine-2,6-dione

Systemtic Name: 8-[(2E)-2-[(4-bromophenyl)methylidene]hydrazinyl]-7-decyl-3-methyl-purine-2,6-dione Openeye Name: 8-[(2E)-2-[(4-bromophenyl)methylene]hydrazino]-7-decyl-3-methyl-purine-2,6-dione CAS Name: 8-[(2E)-2-[(4-bromophenyl)methylidene]hydrazinyl]-7-decyl-3-methylpurine-2,6-dione IUPAC Name: 8-[(2E)-2-[(4-bromophenyl)methylidene]hydrazinyl]-7-decyl-3-methylpurine-2,6-dione Traditional Name: 8-[(N'E)-N'-(4-bromobenzylidene)hydrazino]-7-decyl-3-methyl-xanthine Formula: C23H31BrN6O2 MolecularWeight: 503.43524

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCN1C2=C(N=C1NN=CC3=CC=C(C=C3)Br)N(C(=O)NC2=O)C

Isomeric SMILES

CCCCCCCCCCN1C2=C(N=C1N/N=C/C3=CC=C(C=C3)Br)N(C(=O)NC2=O)C

InChI

InChI=1S/C23H31BrN6O2/c1-3-4-5-6-7-8-9-10-15-30-19-20(29(2)23(32)27-21(19)31)26-22(30)28-25-16-17-11-13-18(24)14-12-17/h11-14,16H,3-10,15H2,1-2H3,(H,26,28)(H,27,31,32)/b25-16+