(2R)-2-[4-[(Z)-[4,6-bis(oxidanylidene)-1-phenyl-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]-2-ethoxy-phenoxy]propanoate

Systemtic Name: (2R)-2-[4-[(Z)-[4,6-bis(oxidanylidene)-1-phenyl-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]-2-ethoxy-phenoxy]propanoate Openeye Name: (2R)-2-[4-[(Z)-(4,6-dioxo-1-phenyl-2-thioxo-hexahydropyrimidin-5-ylidene)methyl]-2-ethoxy-phenoxy]propanoate CAS Name: (2R)-2-[4-[(Z)-(4,6-dioxo-1-phenyl-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]-2-ethoxyphenoxy]propanoate IUPAC Name: (2R)-2-[4-[(Z)-(4,6-dioxo-1-phenyl-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]-2-ethoxyphenoxy]propanoate Traditional Name: (2R)-2-[4-[(Z)-(4,6-diketo-1-phenyl-2-thioxo-hexahydropyrimidin-5-ylidene)methyl]-2-ethoxy-phenoxy]propionate Formula: C22H19N2O6S- MolecularWeight: 439.46106

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C2C(=O)NC(=S)N(C2=O)C3=CC=CC=C3)OC(C)C(=O)[O-]

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C\2/C(=O)NC(=S)N(C2=O)C3=CC=CC=C3)O[C@H](C)C(=O)[O-]

InChI

InChI=1S/C22H20N2O6S/c1-3-29-18-12-14(9-10-17(18)30-13(2)21(27)28)11-16-19(25)23-22(31)24(20(16)26)15-7-5-4-6-8-15/h4-13H,3H2,1-2H3,(H,27,28)(H,23,25,31)/p-1/b16-11-/t13-/m1/s1