5-heptyl-6-methyl-2-sulfanylidene-1,3-diazinan-4-one

Systemtic Name: 5-heptyl-6-methyl-2-sulfanylidene-1,3-diazinan-4-one Openeye Name: 5-heptyl-6-methyl-2-thioxo-hexahydropyrimidin-4-one CAS Name: 5-heptyl-6-methyl-2-sulfanylidene-1,3-diazinan-4-one IUPAC Name: 5-heptyl-6-methyl-2-sulfanylidene-1,3-diazinan-4-one Traditional Name: 5-heptyl-6-methyl-2-thioxo-hexahydropyrimidin-4-one Formula: C12H22N2OS MolecularWeight: 242.38088

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1C(NC(=S)NC1=O)C

Isomeric SMILES

CCCCCCCC1C(NC(=S)NC1=O)C

InChI

InChI=1S/C12H22N2OS/c1-3-4-5-6-7-8-10-9(2)13-12(16)14-11(10)15/h9-10H,3-8H2,1-2H3,(H2,13,14,15,16)