octyl 2-(4-methyl-6-oxidanylidene-2-sulfanylidene-1,3-diazinan-5-yl)hexanoate

Systemtic Name: octyl 2-(4-methyl-6-oxidanylidene-2-sulfanylidene-1,3-diazinan-5-yl)hexanoate Openeye Name: octyl 2-(4-methyl-6-oxo-2-thioxo-hexahydropyrimidin-5-yl)hexanoate CAS Name: 2-(4-methyl-6-oxo-2-sulfanylidene-1,3-diazinan-5-yl)hexanoic acid octyl ester IUPAC Name: octyl 2-(4-methyl-6-oxo-2-sulfanylidene-1,3-diazinan-5-yl)hexanoate Traditional Name: 2-(4-keto-6-methyl-2-thioxo-hexahydropyrimidin-5-yl)hexanoic acid octyl ester Formula: C19H34N2O3S MolecularWeight: 370.54986

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C(CCCC)C1C(NC(=S)NC1=O)C

Isomeric SMILES

CCCCCCCCOC(=O)C(CCCC)C1C(NC(=S)NC1=O)C

InChI

InChI=1S/C19H34N2O3S/c1-4-6-8-9-10-11-13-24-18(23)15(12-7-5-2)16-14(3)20-19(25)21-17(16)22/h14-16H,4-13H2,1-3H3,(H2,20,21,22,25)