3-(4-methoxyphenyl)-2-[(6-oxidanylidene-4,5-dihydro-1H-pyrimidin-2-yl)sulfanyl]prop-2-enoic acid

Systemtic Name: 3-(4-methoxyphenyl)-2-[(6-oxidanylidene-4,5-dihydro-1H-pyrimidin-2-yl)sulfanyl]prop-2-enoic acid Openeye Name: 3-(4-methoxyphenyl)-2-[(6-oxo-4,5-dihydro-1H-pyrimidin-2-yl)sulfanyl]prop-2-enoic acid CAS Name: 3-(4-methoxyphenyl)-2-[(6-oxo-4,5-dihydro-1H-pyrimidin-2-yl)thio]-2-propenoic acid IUPAC Name: 3-(4-methoxyphenyl)-2-[(6-oxo-4,5-dihydro-1H-pyrimidin-2-yl)sulfanyl]prop-2-enoic acid Traditional Name: 2-[(6-keto-4,5-dihydro-1H-pyrimidin-2-yl)thio]-3-(4-methoxyphenyl)acrylic acid Formula: C14H14N2O4S MolecularWeight: 306.33696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=C(C(=O)O)SC2=NCCC(=O)N2

Isomeric SMILES

COC1=CC=C(C=C1)C=C(C(=O)O)SC2=NCCC(=O)N2

InChI

InChI=1S/C14H14N2O4S/c1-20-10-4-2-9(3-5-10)8-11(13(18)19)21-14-15-7-6-12(17)16-14/h2-5,8H,6-7H2,1H3,(H,18,19)(H,15,16,17)