5-hexyl-6-methyl-2-sulfanylidene-1H-pyrimidin-4-one

Systemtic Name: 5-hexyl-6-methyl-2-sulfanylidene-1H-pyrimidin-4-one Openeye Name: 5-hexyl-6-methyl-2-thioxo-1H-pyrimidin-4-one CAS Name: 5-hexyl-6-methyl-2-sulfanylidene-1H-pyrimidin-4-one IUPAC Name: 5-hexyl-6-methyl-2-sulfanylidene-1H-pyrimidin-4-one Traditional Name: 5-hexyl-6-methyl-2-thioxo-1H-pyrimidin-4-one Formula: C11H18N2OS MolecularWeight: 226.33842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(NC(=S)NC1=O)C

Isomeric SMILES

CCCCCCC1=C(NC(=S)NC1=O)C

InChI

InChI=1S/C11H18N2OS/c1-3-4-5-6-7-9-8(2)12-11(15)13-10(9)14/h3-7H2,1-2H3,(H2,12,13,14,15)