2-ethyl-9-methyl-6-propyl-3-sulfanylidene-[1,2,4]triazolo[3,4-f]purin-5-one

Systemtic Name: 2-ethyl-9-methyl-6-propyl-3-sulfanylidene-[1,2,4]triazolo[3,4-f]purin-5-one Openeye Name: 2-ethyl-9-methyl-6-propyl-3-thioxo-[1,2,4]triazolo[3,4-f]purin-5-one CAS Name: 2-ethyl-9-methyl-6-propyl-3-sulfanylidene-[1,2,4]triazolo[3,4-f]purin-5-one IUPAC Name: 2-ethyl-9-methyl-6-propyl-3-sulfanylidene-[1,2,4]triazolo[3,4-f]purin-5-one Traditional Name: 2-ethyl-9-methyl-6-propyl-3-thioxo-[1,2,4]triazolo[3,4-f]purin-5-one Formula: C12H16N6OS MolecularWeight: 292.36004

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C3=NN(C(=S)N3C1=O)CC)N(C=N2)C

Isomeric SMILES

CCCN1C2=C(C3=NN(C(=S)N3C1=O)CC)N(C=N2)C

InChI

InChI=1S/C12H16N6OS/c1-4-6-16-9-8(15(3)7-13-9)10-14-17(5-2)12(20)18(10)11(16)19/h7H,4-6H2,1-3H3