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

Systemtic Name: 5-[(4-ethoxyphenyl)methyl]-6-methyl-2-(2-methylpropylsulfanyl)-1,3-diazinan-4-one Openeye Name: 5-[(4-ethoxyphenyl)methyl]-2-isobutylsulfanyl-6-methyl-hexahydropyrimidin-4-one CAS Name: 5-[(4-ethoxyphenyl)methyl]-6-methyl-2-(2-methylpropylthio)-1,3-diazinan-4-one IUPAC Name: 5-[(4-ethoxyphenyl)methyl]-6-methyl-2-(2-methylpropylsulfanyl)-1,3-diazinan-4-one Traditional Name: 5-(4-ethoxybenzyl)-2-(isobutylthio)-6-methyl-hexahydropyrimidin-4-one Formula: C18H28N2O2S MolecularWeight: 336.49212

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CC2C(NC(NC2=O)SCC(C)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)CC2C(NC(NC2=O)SCC(C)C)C

InChI

InChI=1S/C18H28N2O2S/c1-5-22-15-8-6-14(7-9-15)10-16-13(4)19-18(20-17(16)21)23-11-12(2)3/h6-9,12-13,16,18-19H,5,10-11H2,1-4H3,(H,20,21)