6-octadecyl-2-sulfanylidene-1H-pyrimidin-4-one

Systemtic Name: 6-octadecyl-2-sulfanylidene-1H-pyrimidin-4-one Openeye Name: 6-octadecyl-2-thioxo-1H-pyrimidin-4-one CAS Name: 6-octadecyl-2-sulfanylidene-1H-pyrimidin-4-one IUPAC Name: 6-octadecyl-2-sulfanylidene-1H-pyrimidin-4-one Traditional Name: 6-stearyl-2-thioxo-1H-pyrimidin-4-one Formula: C22H40N2OS MolecularWeight: 380.6308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC1=CC(=O)NC(=S)N1

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC1=CC(=O)NC(=S)N1

InChI

InChI=1S/C22H40N2OS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-19-21(25)24-22(26)23-20/h19H,2-18H2,1H3,(H2,23,24,25,26)