2-[2-[(3-ethanoylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(4-fluorophenyl)-1-methyl-6-oxidanylidene-pyrimidine-5-carboxamide

Systemtic Name: 2-[2-[(3-ethanoylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(4-fluorophenyl)-1-methyl-6-oxidanylidene-pyrimidine-5-carboxamide Openeye Name: 2-[2-(3-acetylanilino)-2-oxo-ethyl]sulfanyl-N-(4-fluorophenyl)-1-methyl-6-oxo-pyrimidine-5-carboxamide CAS Name: 2-[[2-(3-acetylanilino)-2-oxoethyl]thio]-N-(4-fluorophenyl)-1-methyl-6-oxo-5-pyrimidinecarboxamide IUPAC Name: 2-[2-(3-acetylanilino)-2-oxoethyl]sulfanyl-N-(4-fluorophenyl)-1-methyl-6-oxopyrimidine-5-carboxamide Traditional Name: 2-[[2-(3-acetylanilino)-2-keto-ethyl]thio]-N-(4-fluorophenyl)-6-keto-1-methyl-pyrimidine-5-carboxamide Formula: C22H19FN4O4S MolecularWeight: 454.474063

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC=C(C(=O)N2C)C(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC=C(C(=O)N2C)C(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C22H19FN4O4S/c1-13(28)14-4-3-5-17(10-14)25-19(29)12-32-22-24-11-18(21(31)27(22)2)20(30)26-16-8-6-15(23)7-9-16/h3-11H,12H2,1-2H3,(H,25,29)(H,26,30)