1,3-dibutyl-8-methyl-6-sulfanylidene-7H-purin-2-one

Systemtic Name: 1,3-dibutyl-8-methyl-6-sulfanylidene-7H-purin-2-one Openeye Name: 1,3-dibutyl-8-methyl-6-thioxo-7H-purin-2-one CAS Name: 1,3-dibutyl-8-methyl-6-sulfanylidene-7H-purin-2-one IUPAC Name: 1,3-dibutyl-8-methyl-6-sulfanylidene-7H-purin-2-one Traditional Name: 1,3-dibutyl-8-methyl-6-thioxo-7H-purin-2-one Formula: C14H22N4OS MolecularWeight: 294.41568

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=S)N(C1=O)CCCC)NC(=N2)C

Isomeric SMILES

CCCCN1C2=C(C(=S)N(C1=O)CCCC)NC(=N2)C

InChI

InChI=1S/C14H22N4OS/c1-4-6-8-17-12-11(15-10(3)16-12)13(20)18(14(17)19)9-7-5-2/h4-9H2,1-3H3,(H,15,16)