6-ethyl-5-hexadecyl-2-sulfanylidene-1H-pyrimidin-4-one

Systemtic Name: 6-ethyl-5-hexadecyl-2-sulfanylidene-1H-pyrimidin-4-one Openeye Name: 6-ethyl-5-hexadecyl-2-thioxo-1H-pyrimidin-4-one CAS Name: 6-ethyl-5-hexadecyl-2-sulfanylidene-1H-pyrimidin-4-one IUPAC Name: 6-ethyl-5-hexadecyl-2-sulfanylidene-1H-pyrimidin-4-one Traditional Name: 5-cetyl-6-ethyl-2-thioxo-1H-pyrimidin-4-one Formula: C22H40N2OS MolecularWeight: 380.6308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC1=C(NC(=S)NC1=O)CC

Isomeric SMILES

CCCCCCCCCCCCCCCCC1=C(NC(=S)NC1=O)CC

InChI

InChI=1S/C22H40N2OS/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(4-2)23-22(26)24-21(19)25/h3-18H2,1-2H3,(H2,23,24,25,26)