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

Systemtic Name: 2-[4-chloranyl-2-(5-ethanoyl-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-4-yl)phenoxy]ethanoic acid Openeye Name: 2-[2-(5-acetyl-6-phenyl-2-thioxo-3,4-dihydro-1H-pyrimidin-4-yl)-4-chloro-phenoxy]acetic acid CAS Name: 2-[2-(5-acetyl-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-4-yl)-4-chlorophenoxy]acetic acid IUPAC Name: 2-[2-(5-acetyl-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-4-yl)-4-chlorophenoxy]acetic acid Traditional Name: 2-[2-(5-acetyl-6-phenyl-2-thioxo-3,4-dihydro-1H-pyrimidin-4-yl)-4-chloro-phenoxy]acetic acid Formula: C20H17ClN2O4S MolecularWeight: 416.87798

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(NC(=S)NC1C2=C(C=CC(=C2)Cl)OCC(=O)O)C3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=C(NC(=S)NC1C2=C(C=CC(=C2)Cl)OCC(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C20H17ClN2O4S/c1-11(24)17-18(12-5-3-2-4-6-12)22-20(28)23-19(17)14-9-13(21)7-8-15(14)27-10-16(25)26/h2-9,19H,10H2,1H3,(H,25,26)(H2,22,23,28)