2-[2-ethoxy-4-(5-ethoxycarbonyl-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-4-yl)phenoxy]ethanoic acid

Systemtic Name: 2-[2-ethoxy-4-(5-ethoxycarbonyl-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-4-yl)phenoxy]ethanoic acid Openeye Name: 2-[2-ethoxy-4-(5-ethoxycarbonyl-6-phenyl-2-thioxo-3,4-dihydro-1H-pyrimidin-4-yl)phenoxy]acetic acid CAS Name: 2-[2-ethoxy-4-(5-ethoxycarbonyl-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-4-yl)phenoxy]acetic acid IUPAC Name: 2-[2-ethoxy-4-(5-ethoxycarbonyl-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-4-yl)phenoxy]acetic acid Traditional Name: 2-[4-(5-carbethoxy-6-phenyl-2-thioxo-3,4-dihydro-1H-pyrimidin-4-yl)-2-ethoxy-phenoxy]acetic acid Formula: C23H24N2O6S MolecularWeight: 456.51146

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C(=C(NC(=S)N2)C3=CC=CC=C3)C(=O)OCC)OCC(=O)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2C(=C(NC(=S)N2)C3=CC=CC=C3)C(=O)OCC)OCC(=O)O

InChI

InChI=1S/C23H24N2O6S/c1-3-29-17-12-15(10-11-16(17)31-13-18(26)27)21-19(22(28)30-4-2)20(24-23(32)25-21)14-8-6-5-7-9-14/h5-12,21H,3-4,13H2,1-2H3,(H,26,27)(H2,24,25,32)