6-(4-pentoxybutyl)-2-sulfanylidene-1H-pyrimidin-4-one

Systemtic Name: 6-(4-pentoxybutyl)-2-sulfanylidene-1H-pyrimidin-4-one Openeye Name: 6-(4-pentoxybutyl)-2-thioxo-1H-pyrimidin-4-one CAS Name: 6-(4-pentoxybutyl)-2-sulfanylidene-1H-pyrimidin-4-one IUPAC Name: 6-(4-pentoxybutyl)-2-sulfanylidene-1H-pyrimidin-4-one Traditional Name: 6-(4-amoxybutyl)-2-thioxo-1H-pyrimidin-4-one Formula: C13H22N2O2S MolecularWeight: 270.39098

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOCCCCC1=CC(=O)NC(=S)N1

Isomeric SMILES

CCCCCOCCCCC1=CC(=O)NC(=S)N1

InChI

InChI=1S/C13H22N2O2S/c1-2-3-5-8-17-9-6-4-7-11-10-12(16)15-13(18)14-11/h10H,2-9H2,1H3,(H2,14,15,16,18)