N-(5-chloranyl-2-morpholin-4-yl-phenyl)-3-(4-fluorophenyl)-2-methylsulfanyl-imidazole-4-carboxamide

Systemtic Name: N-(5-chloranyl-2-morpholin-4-yl-phenyl)-3-(4-fluorophenyl)-2-methylsulfanyl-imidazole-4-carboxamide Openeye Name: N-(5-chloro-2-morpholino-phenyl)-3-(4-fluorophenyl)-2-methylsulfanyl-imidazole-4-carboxamide CAS Name: N-[5-chloro-2-(4-morpholinyl)phenyl]-3-(4-fluorophenyl)-2-(methylthio)-4-imidazolecarboxamide IUPAC Name: N-(5-chloro-2-morpholin-4-ylphenyl)-3-(4-fluorophenyl)-2-methylsulfanylimidazole-4-carboxamide Traditional Name: N-(5-chloro-2-morpholino-phenyl)-3-(4-fluorophenyl)-2-(methylthio)imidazole-4-carboxamide Formula: C21H20ClFN4O2S MolecularWeight: 446.925503

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(N1C2=CC=C(C=C2)F)C(=O)NC3=C(C=CC(=C3)Cl)N4CCOCC4

Isomeric SMILES

CSC1=NC=C(N1C2=CC=C(C=C2)F)C(=O)NC3=C(C=CC(=C3)Cl)N4CCOCC4

InChI

InChI=1S/C21H20ClFN4O2S/c1-30-21-24-13-19(27(21)16-5-3-15(23)4-6-16)20(28)25-17-12-14(22)2-7-18(17)26-8-10-29-11-9-26/h2-7,12-13H,8-11H2,1H3,(H,25,28)