5-[2-[(4-ethoxyphenyl)methylsulfanyl]ethyl]-6-methyl-2-(3-methylbutylsulfanyl)-1,3-diazinan-4-one

Systemtic Name: 5-[2-[(4-ethoxyphenyl)methylsulfanyl]ethyl]-6-methyl-2-(3-methylbutylsulfanyl)-1,3-diazinan-4-one Openeye Name: 5-[2-[(4-ethoxyphenyl)methylsulfanyl]ethyl]-2-isopentylsulfanyl-6-methyl-hexahydropyrimidin-4-one CAS Name: 5-[2-[(4-ethoxyphenyl)methylthio]ethyl]-6-methyl-2-(3-methylbutylthio)-1,3-diazinan-4-one IUPAC Name: 5-[2-[(4-ethoxyphenyl)methylsulfanyl]ethyl]-6-methyl-2-(3-methylbutylsulfanyl)-1,3-diazinan-4-one Traditional Name: 5-[2-[(4-ethoxybenzyl)thio]ethyl]-2-(isoamylthio)-6-methyl-hexahydropyrimidin-4-one Formula: C21H34N2O2S2 MolecularWeight: 410.63686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CSCCC2C(NC(NC2=O)SCCC(C)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)CSCCC2C(NC(NC2=O)SCCC(C)C)C

InChI

InChI=1S/C21H34N2O2S2/c1-5-25-18-8-6-17(7-9-18)14-26-12-11-19-16(4)22-21(23-20(19)24)27-13-10-15(2)3/h6-9,15-16,19,21-22H,5,10-14H2,1-4H3,(H,23,24)