1-[(4-butoxyphenyl)methyl]-5-methyl-2-sulfanylidene-1,3-diazinan-4-one

Systemtic Name: 1-[(4-butoxyphenyl)methyl]-5-methyl-2-sulfanylidene-1,3-diazinan-4-one Openeye Name: 1-[(4-butoxyphenyl)methyl]-5-methyl-2-thioxo-hexahydropyrimidin-4-one CAS Name: 1-[(4-butoxyphenyl)methyl]-5-methyl-2-sulfanylidene-1,3-diazinan-4-one IUPAC Name: 1-[(4-butoxyphenyl)methyl]-5-methyl-2-sulfanylidene-1,3-diazinan-4-one Traditional Name: 1-(4-butoxybenzyl)-5-methyl-2-thioxo-hexahydropyrimidin-4-one Formula: C16H22N2O2S MolecularWeight: 306.42308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CN2CC(C(=O)NC2=S)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CN2CC(C(=O)NC2=S)C

InChI

InChI=1S/C16H22N2O2S/c1-3-4-9-20-14-7-5-13(6-8-14)11-18-10-12(2)15(19)17-16(18)21/h5-8,12H,3-4,9-11H2,1-2H3,(H,17,19,21)