(5S)-5-methyl-3-(4-pentoxyphenyl)-2-sulfanylidene-1,3-diazinan-4-one

Systemtic Name: (5S)-5-methyl-3-(4-pentoxyphenyl)-2-sulfanylidene-1,3-diazinan-4-one Openeye Name: (5S)-5-methyl-3-(4-pentoxyphenyl)-2-thioxo-hexahydropyrimidin-4-one CAS Name: (5S)-5-methyl-3-(4-pentoxyphenyl)-2-sulfanylidene-1,3-diazinan-4-one IUPAC Name: (5S)-5-methyl-3-(4-pentoxyphenyl)-2-sulfanylidene-1,3-diazinan-4-one Traditional Name: (5S)-3-(4-amoxyphenyl)-5-methyl-2-thioxo-hexahydropyrimidin-4-one Formula: C16H22N2O2S MolecularWeight: 306.42308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)N2C(=O)C(CNC2=S)C

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)N2C(=O)[C@H](CNC2=S)C

InChI

InChI=1S/C16H22N2O2S/c1-3-4-5-10-20-14-8-6-13(7-9-14)18-15(19)12(2)11-17-16(18)21/h6-9,12H,3-5,10-11H2,1-2H3,(H,17,21)/t12-/m0/s1