3-(4-fluorophenyl)-2-methylsulfanyl-N-[(3-morpholin-4-ylthiolan-3-yl)methyl]imidazole-4-carboxamide

Systemtic Name: 3-(4-fluorophenyl)-2-methylsulfanyl-N-[(3-morpholin-4-ylthiolan-3-yl)methyl]imidazole-4-carboxamide Openeye Name: 3-(4-fluorophenyl)-2-methylsulfanyl-N-[(3-morpholinotetrahydrothiophen-3-yl)methyl]imidazole-4-carboxamide CAS Name: 3-(4-fluorophenyl)-2-(methylthio)-N-[[3-(4-morpholinyl)-3-thiolanyl]methyl]-4-imidazolecarboxamide IUPAC Name: 3-(4-fluorophenyl)-2-methylsulfanyl-N-[(3-morpholin-4-ylthiolan-3-yl)methyl]imidazole-4-carboxamide Traditional Name: 3-(4-fluorophenyl)-2-(methylthio)-N-[(3-morpholinotetrahydrothiophen-3-yl)methyl]imidazole-4-carboxamide Formula: C20H25FN4O2S2 MolecularWeight: 436.566503

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(N1C2=CC=C(C=C2)F)C(=O)NCC3(CCSC3)N4CCOCC4

Isomeric SMILES

CSC1=NC=C(N1C2=CC=C(C=C2)F)C(=O)NCC3(CCSC3)N4CCOCC4

InChI

InChI=1S/C20H25FN4O2S2/c1-28-19-22-12-17(25(19)16-4-2-15(21)3-5-16)18(26)23-13-20(6-11-29-14-20)24-7-9-27-10-8-24/h2-5,12H,6-11,13-14H2,1H3,(H,23,26)