7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-[2-(1-phenylbutylidene)hydrazinyl]purine-2,6-dione

Systemtic Name: 7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-[2-(1-phenylbutylidene)hydrazinyl]purine-2,6-dione Openeye Name: 7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-[2-(1-phenylbutylidene)hydrazino]purine-2,6-dione CAS Name: 7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-[2-(1-phenylbutylidene)hydrazinyl]purine-2,6-dione IUPAC Name: 7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-[2-(1-phenylbutylidene)hydrazinyl]purine-2,6-dione Traditional Name: 7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-[N'-(1-phenylbutylidene)hydrazino]xanthine Formula: C25H28N6O3 MolecularWeight: 460.52822

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=NNC1=NC2=C(N1CCC3=CC=C(C=C3)OC)C(=O)NC(=O)N2C)C4=CC=CC=C4

Isomeric SMILES

CCCC(=NNC1=NC2=C(N1CCC3=CC=C(C=C3)OC)C(=O)NC(=O)N2C)C4=CC=CC=C4

InChI

InChI=1S/C25H28N6O3/c1-4-8-20(18-9-6-5-7-10-18)28-29-24-26-22-21(23(32)27-25(33)30(22)2)31(24)16-15-17-11-13-19(34-3)14-12-17/h5-7,9-14H,4,8,15-16H2,1-3H3,(H,26,29)(H,27,32,33)