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

Systemtic Name: (2S)-2-[2-ethoxy-4-[(Z)-[1-(2-ethylphenyl)-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]phenoxy]propanoate Openeye Name: (2S)-2-[2-ethoxy-4-[(Z)-[1-(2-ethylphenyl)-4,6-dioxo-2-thioxo-hexahydropyrimidin-5-ylidene]methyl]phenoxy]propanoate CAS Name: (2S)-2-[2-ethoxy-4-[(Z)-[1-(2-ethylphenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]phenoxy]propanoate IUPAC Name: (2S)-2-[2-ethoxy-4-[(Z)-[1-(2-ethylphenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]phenoxy]propanoate Traditional Name: (2S)-2-[2-ethoxy-4-[(Z)-[1-(2-ethylphenyl)-4,6-diketo-2-thioxo-hexahydropyrimidin-5-ylidene]methyl]phenoxy]propionate Formula: C24H23N2O6S- MolecularWeight: 467.51422

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N2C(=O)C(=CC3=CC(=C(C=C3)OC(C)C(=O)[O-])OCC)C(=O)NC2=S

Isomeric SMILES

CCC1=CC=CC=C1N2C(=O)/C(=C\C3=CC(=C(C=C3)O[C@@H](C)C(=O)[O-])OCC)/C(=O)NC2=S

InChI

InChI=1S/C24H24N2O6S/c1-4-16-8-6-7-9-18(16)26-22(28)17(21(27)25-24(26)33)12-15-10-11-19(20(13-15)31-5-2)32-14(3)23(29)30/h6-14H,4-5H2,1-3H3,(H,29,30)(H,25,27,33)/p-1/b17-12-/t14-/m0/s1