8-(5-ethanoylthiophen-2-yl)-1,3,7-trimethyl-purine-2,6-dione

Systemtic Name: 8-(5-ethanoylthiophen-2-yl)-1,3,7-trimethyl-purine-2,6-dione Openeye Name: 8-(5-acetyl-2-thienyl)-1,3,7-trimethyl-purine-2,6-dione CAS Name: 8-(5-acetyl-2-thiophenyl)-1,3,7-trimethylpurine-2,6-dione IUPAC Name: 8-(5-acetylthiophen-2-yl)-1,3,7-trimethylpurine-2,6-dione Traditional Name: 8-(5-acetyl-2-thienyl)-1,3,7-trimethyl-xanthine Formula: C14H14N4O3S MolecularWeight: 318.35096

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(S1)C2=NC3=C(N2C)C(=O)N(C(=O)N3C)C

Isomeric SMILES

CC(=O)C1=CC=C(S1)C2=NC3=C(N2C)C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C14H14N4O3S/c1-7(19)8-5-6-9(22-8)11-15-12-10(16(11)2)13(20)18(4)14(21)17(12)3/h5-6H,1-4H3