methyl 2-[(4S)-4-(2-chloranyl-6-fluoranyl-phenyl)-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]-2-oxidanylidene-ethanoate

Systemtic Name: methyl 2-[(4S)-4-(2-chloranyl-6-fluoranyl-phenyl)-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]-2-oxidanylidene-ethanoate Openeye Name: methyl 2-[(4S)-4-(2-chloro-6-fluoro-phenyl)-6-phenyl-2-thioxo-3,4-dihydro-1H-pyrimidin-5-yl]-2-oxo-acetate CAS Name: 2-[(4S)-4-(2-chloro-6-fluorophenyl)-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]-2-oxoacetic acid methyl ester IUPAC Name: methyl 2-[(4S)-4-(2-chloro-6-fluorophenyl)-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]-2-oxoacetate Traditional Name: 2-[(4S)-4-(2-chloro-6-fluoro-phenyl)-6-phenyl-2-thioxo-3,4-dihydro-1H-pyrimidin-5-yl]-2-keto-acetic acid methyl ester Formula: C19H14ClFN2O3S MolecularWeight: 404.842463

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=O)C1=C(NC(=S)NC1C2=C(C=CC=C2Cl)F)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C(=O)C1=C(NC(=S)N[C@@H]1C2=C(C=CC=C2Cl)F)C3=CC=CC=C3

InChI

InChI=1S/C19H14ClFN2O3S/c1-26-18(25)17(24)14-15(10-6-3-2-4-7-10)22-19(27)23-16(14)13-11(20)8-5-9-12(13)21/h2-9,16H,1H3,(H2,22,23,27)/t16-/m1/s1