ethyl 2-[2-[2,6-bis(oxidanylidene)-4-phenyl-1,3-diazinan-1-yl]ethylsulfanyl]ethanoate

Systemtic Name: ethyl 2-[2-[2,6-bis(oxidanylidene)-4-phenyl-1,3-diazinan-1-yl]ethylsulfanyl]ethanoate Openeye Name: ethyl 2-[2-(2,6-dioxo-4-phenyl-hexahydropyrimidin-1-yl)ethylsulfanyl]acetate CAS Name: 2-[2-(2,6-dioxo-4-phenyl-1,3-diazinan-1-yl)ethylthio]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(2,6-dioxo-4-phenyl-1,3-diazinan-1-yl)ethylsulfanyl]acetate Traditional Name: 2-[2-(2,6-diketo-4-phenyl-hexahydropyrimidin-1-yl)ethylthio]acetic acid ethyl ester Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSCCN1C(=O)CC(NC1=O)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CSCCN1C(=O)CC(NC1=O)C2=CC=CC=C2

InChI

InChI=1S/C16H20N2O4S/c1-2-22-15(20)11-23-9-8-18-14(19)10-13(17-16(18)21)12-6-4-3-5-7-12/h3-7,13H,2,8-11H2,1H3,(H,17,21)