7-(2-methoxyethyl)-3-propyl-8-thiophen-2-yl-purine-2,6-dione

Systemtic Name: 7-(2-methoxyethyl)-3-propyl-8-thiophen-2-yl-purine-2,6-dione Openeye Name: 7-(2-methoxyethyl)-3-propyl-8-(2-thienyl)purine-2,6-dione CAS Name: 7-(2-methoxyethyl)-3-propyl-8-thiophen-2-ylpurine-2,6-dione IUPAC Name: 7-(2-methoxyethyl)-3-propyl-8-thiophen-2-ylpurine-2,6-dione Traditional Name: 7-(2-methoxyethyl)-3-propyl-8-(2-thienyl)xanthine Formula: C15H18N4O3S MolecularWeight: 334.39342

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)NC1=O)N(C(=N2)C3=CC=CS3)CCOC

Isomeric SMILES

CCCN1C2=C(C(=O)NC1=O)N(C(=N2)C3=CC=CS3)CCOC

InChI

InChI=1S/C15H18N4O3S/c1-3-6-19-13-11(14(20)17-15(19)21)18(7-8-22-2)12(16-13)10-5-4-9-23-10/h4-5,9H,3,6-8H2,1-2H3,(H,17,20,21)