ethyl 4-[1-[(2-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanyl-2-(furan-2-yl)-6-methyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[1-[(2-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanyl-2-(furan-2-yl)-6-methyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[2-(2-fluoroanilino)-1-methyl-2-oxo-ethyl]sulfanyl-2-(2-furyl)-6-methyl-pyrimidine-5-carboxylate CAS Name: 4-[[1-(2-fluoroanilino)-1-oxopropan-2-yl]thio]-2-(2-furanyl)-6-methyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-(2-fluoroanilino)-1-oxopropan-2-yl]sulfanyl-2-(furan-2-yl)-6-methylpyrimidine-5-carboxylate Traditional Name: 4-[[2-(2-fluoroanilino)-2-keto-1-methyl-ethyl]thio]-2-(2-furyl)-6-methyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C21H20FN3O4S MolecularWeight: 429.464603

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N=C1SC(C)C(=O)NC2=CC=CC=C2F)C3=CC=CO3)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(N=C1SC(C)C(=O)NC2=CC=CC=C2F)C3=CC=CO3)C

InChI

InChI=1S/C21H20FN3O4S/c1-4-28-21(27)17-12(2)23-18(16-10-7-11-29-16)25-20(17)30-13(3)19(26)24-15-9-6-5-8-14(15)22/h5-11,13H,4H2,1-3H3,(H,24,26)