1-ethyl-3-(furan-2-ylmethyl)-8-(thiophen-2-ylmethyl)-7H-purine-2,6-dione

Systemtic Name: 1-ethyl-3-(furan-2-ylmethyl)-8-(thiophen-2-ylmethyl)-7H-purine-2,6-dione Openeye Name: 1-ethyl-3-(2-furylmethyl)-8-(2-thienylmethyl)-7H-purine-2,6-dione CAS Name: 1-ethyl-3-(2-furanylmethyl)-8-(thiophen-2-ylmethyl)-7H-purine-2,6-dione IUPAC Name: 1-ethyl-3-(furan-2-ylmethyl)-8-(thiophen-2-ylmethyl)-7H-purine-2,6-dione Traditional Name: 1-ethyl-3-(2-furfuryl)-8-(2-thenyl)-7H-purine-2,6-quinone Formula: C17H16N4O3S MolecularWeight: 356.39894

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C(N2)CC3=CC=CS3)N(C1=O)CC4=CC=CO4

Isomeric SMILES

CCN1C(=O)C2=C(N=C(N2)CC3=CC=CS3)N(C1=O)CC4=CC=CO4

InChI

InChI=1S/C17H16N4O3S/c1-2-20-16(22)14-15(19-13(18-14)9-12-6-4-8-25-12)21(17(20)23)10-11-5-3-7-24-11/h3-8H,2,9-10H2,1H3,(H,18,19)