6-methyl-3-[(E)-octadec-9-enyl]-2-sulfanylidene-1H-pyrimidin-4-one

Systemtic Name: 6-methyl-3-[(E)-octadec-9-enyl]-2-sulfanylidene-1H-pyrimidin-4-one Openeye Name: 6-methyl-3-[(E)-octadec-9-enyl]-2-thioxo-1H-pyrimidin-4-one CAS Name: 6-methyl-3-[(E)-octadec-9-enyl]-2-sulfanylidene-1H-pyrimidin-4-one IUPAC Name: 6-methyl-3-[(E)-octadec-9-enyl]-2-sulfanylidene-1H-pyrimidin-4-one Traditional Name: 6-methyl-3-[(E)-octadec-9-enyl]-2-thioxo-1H-pyrimidin-4-one Formula: C23H40N2OS MolecularWeight: 392.6415

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCN1C(=O)C=C(NC1=S)C

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCN1C(=O)C=C(NC1=S)C

InChI

InChI=1S/C23H40N2OS/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25-22(26)20-21(2)24-23(25)27/h10-11,20H,3-9,12-19H2,1-2H3,(H,24,27)/b11-10+