ethyl 6-[[1-(3-fluorophenyl)imidazol-2-yl]sulfanylmethyl]-2-oxidanylidene-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[[1-(3-fluorophenyl)imidazol-2-yl]sulfanylmethyl]-2-oxidanylidene-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[[1-(3-fluorophenyl)imidazol-2-yl]sulfanylmethyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[[1-(3-fluorophenyl)-2-imidazolyl]thio]methyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[[1-(3-fluorophenyl)imidazol-2-yl]sulfanylmethyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[[[1-(3-fluorophenyl)imidazol-2-yl]thio]methyl]-2-keto-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C23H21FN4O3S MolecularWeight: 452.501243

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2)CSC3=NC=CN3C4=CC(=CC=C4)F

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2)CSC3=NC=CN3C4=CC(=CC=C4)F

InChI

InChI=1S/C23H21FN4O3S/c1-2-31-21(29)19-18(26-22(30)27-20(19)15-7-4-3-5-8-15)14-32-23-25-11-12-28(23)17-10-6-9-16(24)13-17/h3-13,20H,2,14H2,1H3,(H2,26,27,30)