8-(2-butan-2-ylidenehydrazinyl)-7-hexadecyl-3-methyl-purine-2,6-dione

Systemtic Name: 8-(2-butan-2-ylidenehydrazinyl)-7-hexadecyl-3-methyl-purine-2,6-dione Openeye Name: 7-hexadecyl-3-methyl-8-[2-(1-methylpropylidene)hydrazino]purine-2,6-dione CAS Name: 8-(2-butan-2-ylidenehydrazinyl)-7-hexadecyl-3-methylpurine-2,6-dione IUPAC Name: 8-(2-butan-2-ylidenehydrazinyl)-7-hexadecyl-3-methylpurine-2,6-dione Traditional Name: 7-cetyl-3-methyl-8-[N'-(1-methylpropylidene)hydrazino]xanthine Formula: C26H46N6O2 MolecularWeight: 474.68244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN1C2=C(N=C1NN=C(C)CC)N(C(=O)NC2=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCN1C2=C(N=C1NN=C(C)CC)N(C(=O)NC2=O)C

InChI

InChI=1S/C26H46N6O2/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-32-22-23(31(4)26(34)28-24(22)33)27-25(32)30-29-21(3)6-2/h5-20H2,1-4H3,(H,27,30)(H,28,33,34)