2-[5-[(E)-[1-(4-ethoxyphenyl)-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]furan-2-yl]benzoate

Systemtic Name: 2-[5-[(E)-[1-(4-ethoxyphenyl)-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]furan-2-yl]benzoate Openeye Name: 2-[5-[(E)-[1-(4-ethoxyphenyl)-4,6-dioxo-2-thioxo-hexahydropyrimidin-5-ylidene]methyl]-2-furyl]benzoate CAS Name: 2-[5-[(E)-[1-(4-ethoxyphenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]-2-furanyl]benzoate IUPAC Name: 2-[5-[(E)-[1-(4-ethoxyphenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]furan-2-yl]benzoate Traditional Name: 2-[5-[(E)-(4,6-diketo-1-p-phenetyl-2-thioxo-hexahydropyrimidin-5-ylidene)methyl]-2-furyl]benzoate Formula: C24H17N2O6S- MolecularWeight: 461.46658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(O3)C4=CC=CC=C4C(=O)[O-])C(=O)NC2=S

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)/C(=C/C3=CC=C(O3)C4=CC=CC=C4C(=O)[O-])/C(=O)NC2=S

InChI

InChI=1S/C24H18N2O6S/c1-2-31-15-9-7-14(8-10-15)26-22(28)19(21(27)25-24(26)33)13-16-11-12-20(32-16)17-5-3-4-6-18(17)23(29)30/h3-13H,2H2,1H3,(H,29,30)(H,25,27,33)/p-1/b19-13+