6-(3-piperidin-1-ylpropyl)-2-sulfanylidene-5-tetradecyl-1H-pyrimidin-4-one

Systemtic Name: 6-(3-piperidin-1-ylpropyl)-2-sulfanylidene-5-tetradecyl-1H-pyrimidin-4-one Openeye Name: 6-[3-(1-piperidyl)propyl]-5-tetradecyl-2-thioxo-1H-pyrimidin-4-one CAS Name: 6-[3-(1-piperidinyl)propyl]-2-sulfanylidene-5-tetradecyl-1H-pyrimidin-4-one IUPAC Name: 6-(3-piperidin-1-ylpropyl)-2-sulfanylidene-5-tetradecyl-1H-pyrimidin-4-one Traditional Name: 5-myristyl-6-(3-piperidinopropyl)-2-thioxo-1H-pyrimidin-4-one Formula: C26H47N3OS MolecularWeight: 449.73588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC1=C(NC(=S)NC1=O)CCCN2CCCCC2

Isomeric SMILES

CCCCCCCCCCCCCCC1=C(NC(=S)NC1=O)CCCN2CCCCC2

InChI

InChI=1S/C26H47N3OS/c1-2-3-4-5-6-7-8-9-10-11-12-14-18-23-24(27-26(31)28-25(23)30)19-17-22-29-20-15-13-16-21-29/h2-22H2,1H3,(H2,27,28,30,31)