3-methyl-7-(3-phenylpropyl)-8-pyrrolidin-1-yl-purine-2,6-dione

Systemtic Name: 3-methyl-7-(3-phenylpropyl)-8-pyrrolidin-1-yl-purine-2,6-dione Openeye Name: 3-methyl-7-(3-phenylpropyl)-8-pyrrolidin-1-yl-purine-2,6-dione CAS Name: 3-methyl-7-(3-phenylpropyl)-8-(1-pyrrolidinyl)purine-2,6-dione IUPAC Name: 3-methyl-7-(3-phenylpropyl)-8-pyrrolidin-1-ylpurine-2,6-dione Traditional Name: 3-methyl-7-(3-phenylpropyl)-8-pyrrolidino-xanthine Formula: C19H23N5O2 MolecularWeight: 353.41822

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C(=N2)N3CCCC3)CCCC4=CC=CC=C4

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C(=N2)N3CCCC3)CCCC4=CC=CC=C4

InChI

InChI=1S/C19H23N5O2/c1-22-16-15(17(25)21-19(22)26)24(18(20-16)23-11-5-6-12-23)13-7-10-14-8-3-2-4-9-14/h2-4,8-9H,5-7,10-13H2,1H3,(H,21,25,26)