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

Systemtic Name: 2-[4-chloranyl-2-[(4R)-5-ethanoyl-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-4-yl]phenoxy]ethanoate Openeye Name: 2-[2-[(4R)-5-acetyl-6-phenyl-2-thioxo-3,4-dihydro-1H-pyrimidin-4-yl]-4-chloro-phenoxy]acetate CAS Name: 2-[2-[(4R)-5-acetyl-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-4-yl]-4-chlorophenoxy]acetate IUPAC Name: 2-[2-[(4R)-5-acetyl-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-4-yl]-4-chlorophenoxy]acetate Traditional Name: 2-[2-[(4R)-5-acetyl-6-phenyl-2-thioxo-3,4-dihydro-1H-pyrimidin-4-yl]-4-chloro-phenoxy]acetate Formula: C20H16ClN2O4S- MolecularWeight: 415.87004

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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)N[C@@H]1C2=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)/p-1/t19-/m1/s1