5-fluoranyl-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 5-fluoranyl-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-1-benzothiophene-2-carboxamide Openeye Name: 5-fluoro-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]benzothiophene-2-carboxamide CAS Name: 5-fluoro-N-[[1-(4-morpholin-4-iumyl)cyclohexyl]methyl]-1-benzothiophene-2-carboxamide IUPAC Name: 5-fluoro-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-1-benzothiophene-2-carboxamide Traditional Name: 5-fluoro-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]benzothiophene-2-carboxamide Formula: C20H26FN2O2S+ MolecularWeight: 377.496043

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)C2=CC3=C(S2)C=CC(=C3)F)[NH+]4CCOCC4

Isomeric SMILES

C1CCC(CC1)(CNC(=O)C2=CC3=C(S2)C=CC(=C3)F)[NH+]4CCOCC4

InChI

InChI=1S/C20H25FN2O2S/c21-16-4-5-17-15(12-16)13-18(26-17)19(24)22-14-20(6-2-1-3-7-20)23-8-10-25-11-9-23/h4-5,12-13H,1-3,6-11,14H2,(H,22,24)/p+1