(E)-3-(4-dimethylaminophenyl)-2-[(6-oxidanylidene-4,5-dihydro-1H-pyrimidin-2-yl)sulfanyl]prop-2-enoate

Systemtic Name: (E)-3-(4-dimethylaminophenyl)-2-[(6-oxidanylidene-4,5-dihydro-1H-pyrimidin-2-yl)sulfanyl]prop-2-enoate Openeye Name: (E)-3-(4-dimethylaminophenyl)-2-[(6-oxo-4,5-dihydro-1H-pyrimidin-2-yl)sulfanyl]prop-2-enoate CAS Name: (E)-3-(4-dimethylaminophenyl)-2-[(6-oxo-4,5-dihydro-1H-pyrimidin-2-yl)thio]-2-propenoate IUPAC Name: (E)-3-(4-dimethylaminophenyl)-2-[(6-oxo-4,5-dihydro-1H-pyrimidin-2-yl)sulfanyl]prop-2-enoate Traditional Name: (E)-3-(4-dimethylaminophenyl)-2-[(6-keto-4,5-dihydro-1H-pyrimidin-2-yl)thio]acrylate Formula: C15H16N3O3S- MolecularWeight: 318.37084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C=C(C(=O)[O-])SC2=NCCC(=O)N2

Isomeric SMILES

CN(C)C1=CC=C(C=C1)/C=C(\C(=O)[O-])/SC2=NCCC(=O)N2

InChI

InChI=1S/C15H17N3O3S/c1-18(2)11-5-3-10(4-6-11)9-12(14(20)21)22-15-16-8-7-13(19)17-15/h3-6,9H,7-8H2,1-2H3,(H,20,21)(H,16,17,19)/p-1/b12-9+