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

Systemtic Name: 8-[(2Z)-2-[1-(4-bromophenyl)ethylidene]hydrazinyl]-3-methyl-7-nonyl-purine-2,6-dione Openeye Name: 8-[(2Z)-2-[1-(4-bromophenyl)ethylidene]hydrazino]-3-methyl-7-nonyl-purine-2,6-dione CAS Name: 8-[(2Z)-2-[1-(4-bromophenyl)ethylidene]hydrazinyl]-3-methyl-7-nonylpurine-2,6-dione IUPAC Name: 8-[(2Z)-2-[1-(4-bromophenyl)ethylidene]hydrazinyl]-3-methyl-7-nonylpurine-2,6-dione Traditional Name: 8-[(N'Z)-N'-[1-(4-bromophenyl)ethylidene]hydrazino]-3-methyl-7-nonyl-xanthine Formula: C23H31BrN6O2 MolecularWeight: 503.43524

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCN1C2=C(N=C1NN=C(C)C3=CC=C(C=C3)Br)N(C(=O)NC2=O)C

Isomeric SMILES

CCCCCCCCCN1C2=C(N=C1N/N=C(/C)\C3=CC=C(C=C3)Br)N(C(=O)NC2=O)C

InChI

InChI=1S/C23H31BrN6O2/c1-4-5-6-7-8-9-10-15-30-19-20(29(3)23(32)26-21(19)31)25-22(30)28-27-16(2)17-11-13-18(24)14-12-17/h11-14H,4-10,15H2,1-3H3,(H,25,28)(H,26,31,32)/b27-16-