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

Systemtic Name: 3-(furan-2-ylmethyl)-1-prop-2-ynyl-8-(thiophen-2-ylmethyl)-7H-purine-2,6-dione Openeye Name: 3-(2-furylmethyl)-1-prop-2-ynyl-8-(2-thienylmethyl)-7H-purine-2,6-dione CAS Name: 3-(2-furanylmethyl)-1-prop-2-ynyl-8-(thiophen-2-ylmethyl)-7H-purine-2,6-dione IUPAC Name: 3-(furan-2-ylmethyl)-1-prop-2-ynyl-8-(thiophen-2-ylmethyl)-7H-purine-2,6-dione Traditional Name: 3-(2-furfuryl)-1-propargyl-8-(2-thenyl)-7H-purine-2,6-quinone Formula: C18H14N4O3S MolecularWeight: 366.39376

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14N4O3S/c1-2-7-21-17(23)15-16(20-14(19-15)10-13-6-4-9-26-13)22(18(21)24)11-12-5-3-8-25-12/h1,3-6,8-9H,7,10-11H2,(H,19,20)