8-(2-butan-2-ylidenehydrazinyl)-7-[2-(4-methoxyphenyl)ethyl]-3-methyl-purine-2,6-dione

Systemtic Name: 8-(2-butan-2-ylidenehydrazinyl)-7-[2-(4-methoxyphenyl)ethyl]-3-methyl-purine-2,6-dione Openeye Name: 7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-[2-(1-methylpropylidene)hydrazino]purine-2,6-dione CAS Name: 8-(2-butan-2-ylidenehydrazinyl)-7-[2-(4-methoxyphenyl)ethyl]-3-methylpurine-2,6-dione IUPAC Name: 8-(2-butan-2-ylidenehydrazinyl)-7-[2-(4-methoxyphenyl)ethyl]-3-methylpurine-2,6-dione Traditional Name: 7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-[N'-(1-methylpropylidene)hydrazino]xanthine Formula: C19H24N6O3 MolecularWeight: 384.43226

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=NNC1=NC2=C(N1CCC3=CC=C(C=C3)OC)C(=O)NC(=O)N2C)C

Isomeric SMILES

CCC(=NNC1=NC2=C(N1CCC3=CC=C(C=C3)OC)C(=O)NC(=O)N2C)C

InChI

InChI=1S/C19H24N6O3/c1-5-12(2)22-23-18-20-16-15(17(26)21-19(27)24(16)3)25(18)11-10-13-6-8-14(28-4)9-7-13/h6-9H,5,10-11H2,1-4H3,(H,20,23)(H,21,26,27)