2-[[5-[(4-methoxyphenyl)methyl]-4-methyl-6-oxidanylidene-1,3-diazinan-2-yl]sulfanyl]ethanoic acid

Systemtic Name: 2-[[5-[(4-methoxyphenyl)methyl]-4-methyl-6-oxidanylidene-1,3-diazinan-2-yl]sulfanyl]ethanoic acid Openeye Name: 2-[5-[(4-methoxyphenyl)methyl]-4-methyl-6-oxo-hexahydropyrimidin-2-yl]sulfanylacetic acid CAS Name: 2-[[5-[(4-methoxyphenyl)methyl]-4-methyl-6-oxo-1,3-diazinan-2-yl]thio]acetic acid IUPAC Name: 2-[[5-[(4-methoxyphenyl)methyl]-4-methyl-6-oxo-1,3-diazinan-2-yl]sulfanyl]acetic acid Traditional Name: 2-[(4-keto-6-methyl-5-p-anisyl-hexahydropyrimidin-2-yl)thio]acetic acid Formula: C15H20N2O4S MolecularWeight: 324.3953

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(=O)NC(N1)SCC(=O)O)CC2=CC=C(C=C2)OC

Isomeric SMILES

CC1C(C(=O)NC(N1)SCC(=O)O)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C15H20N2O4S/c1-9-12(7-10-3-5-11(21-2)6-4-10)14(20)17-15(16-9)22-8-13(18)19/h3-6,9,12,15-16H,7-8H2,1-2H3,(H,17,20)(H,18,19)