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

Systemtic Name: N-(4-fluorophenyl)-1-methyl-6-oxidanylidene-2-[2-oxidanylidene-2-(phenethylamino)ethyl]sulfanyl-pyrimidine-5-carboxamide Openeye Name: N-(4-fluorophenyl)-1-methyl-6-oxo-2-[2-oxo-2-(phenethylamino)ethyl]sulfanyl-pyrimidine-5-carboxamide CAS Name: N-(4-fluorophenyl)-1-methyl-6-oxo-2-[[2-oxo-2-(phenethylamino)ethyl]thio]-5-pyrimidinecarboxamide IUPAC Name: N-(4-fluorophenyl)-1-methyl-6-oxo-2-[2-oxo-2-(phenethylamino)ethyl]sulfanylpyrimidine-5-carboxamide Traditional Name: N-(4-fluorophenyl)-6-keto-2-[[2-keto-2-(phenethylamino)ethyl]thio]-1-methyl-pyrimidine-5-carboxamide Formula: C22H21FN4O3S MolecularWeight: 440.490543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CN=C1SCC(=O)NCCC2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

CN1C(=O)C(=CN=C1SCC(=O)NCCC2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C22H21FN4O3S/c1-27-21(30)18(20(29)26-17-9-7-16(23)8-10-17)13-25-22(27)31-14-19(28)24-12-11-15-5-3-2-4-6-15/h2-10,13H,11-12,14H2,1H3,(H,24,28)(H,26,29)