6-propyl-3-thiophen-2-yl-1H-[1,2,4]triazolo[3,4-f]purin-5-one

Systemtic Name: 6-propyl-3-thiophen-2-yl-1H-[1,2,4]triazolo[3,4-f]purin-5-one Openeye Name: 6-propyl-3-(2-thienyl)-1H-[1,2,4]triazolo[3,4-f]purin-5-one CAS Name: 6-propyl-3-thiophen-2-yl-1H-[1,2,4]triazolo[3,4-f]purin-5-one IUPAC Name: 6-propyl-3-thiophen-2-yl-1H-[1,2,4]triazolo[3,4-f]purin-5-one Traditional Name: 6-propyl-3-(2-thienyl)-1H-[1,2,4]triazolo[3,4-f]purin-5-one Formula: C13H12N6OS MolecularWeight: 300.33898

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=NC=NC2=C3NN=C(N3C1=O)C4=CC=CS4

Isomeric SMILES

CCCN1C2=NC=NC2=C3NN=C(N3C1=O)C4=CC=CS4

InChI

InChI=1S/C13H12N6OS/c1-2-5-18-11-9(14-7-15-11)12-17-16-10(19(12)13(18)20)8-4-3-6-21-8/h3-4,6-7,17H,2,5H2,1H3