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

Systemtic Name: 2-phenoxyethyl 2-(4-methyl-6-oxidanylidene-2-sulfanylidene-1,3-diazinan-5-yl)hexanoate Openeye Name: 2-phenoxyethyl 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 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl 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 2-phenoxyethyl ester Formula: C19H26N2O4S MolecularWeight: 378.48574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1C(NC(=S)NC1=O)C)C(=O)OCCOC2=CC=CC=C2

Isomeric SMILES

CCCCC(C1C(NC(=S)NC1=O)C)C(=O)OCCOC2=CC=CC=C2

InChI

InChI=1S/C19H26N2O4S/c1-3-4-10-15(16-13(2)20-19(26)21-17(16)22)18(23)25-12-11-24-14-8-6-5-7-9-14/h5-9,13,15-16H,3-4,10-12H2,1-2H3,(H2,20,21,22,26)