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

Systemtic Name: 2-[4-chloranyl-2-methoxy-6-[6-phenyl-5-(phenylcarbonyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-4-yl]phenoxy]ethanoic acid Openeye Name: 2-[2-(5-benzoyl-6-phenyl-2-thioxo-3,4-dihydro-1H-pyrimidin-4-yl)-4-chloro-6-methoxy-phenoxy]acetic acid CAS Name: 2-[2-(5-benzoyl-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-4-yl)-4-chloro-6-methoxyphenoxy]acetic acid IUPAC Name: 2-[2-(5-benzoyl-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-4-yl)-4-chloro-6-methoxyphenoxy]acetic acid Traditional Name: 2-[2-(5-benzoyl-6-phenyl-2-thioxo-3,4-dihydro-1H-pyrimidin-4-yl)-4-chloro-6-methoxy-phenoxy]acetic acid Formula: C26H21ClN2O5S MolecularWeight: 508.97334

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)Cl)C2C(=C(NC(=S)N2)C3=CC=CC=C3)C(=O)C4=CC=CC=C4)OCC(=O)O

Isomeric SMILES

COC1=C(C(=CC(=C1)Cl)C2C(=C(NC(=S)N2)C3=CC=CC=C3)C(=O)C4=CC=CC=C4)OCC(=O)O

InChI

InChI=1S/C26H21ClN2O5S/c1-33-19-13-17(27)12-18(25(19)34-14-20(30)31)23-21(24(32)16-10-6-3-7-11-16)22(28-26(35)29-23)15-8-4-2-5-9-15/h2-13,23H,14H2,1H3,(H,30,31)(H2,28,29,35)