N-[2-(cyclohexen-1-yl)ethyl]-2-[(2-fluorophenyl)methylsulfanyl]pyridine-3-carboxamide

Systemtic Name: N-[2-(cyclohexen-1-yl)ethyl]-2-[(2-fluorophenyl)methylsulfanyl]pyridine-3-carboxamide Openeye Name: N-[2-(cyclohexen-1-yl)ethyl]-2-[(2-fluorophenyl)methylsulfanyl]pyridine-3-carboxamide CAS Name: N-[2-(1-cyclohexenyl)ethyl]-2-[(2-fluorophenyl)methylthio]-3-pyridinecarboxamide IUPAC Name: N-[2-(cyclohexen-1-yl)ethyl]-2-[(2-fluorophenyl)methylsulfanyl]pyridine-3-carboxamide Traditional Name: N-[2-(cyclohexen-1-yl)ethyl]-2-[(2-fluorobenzyl)thio]nicotinamide Formula: C21H23FN2OS MolecularWeight: 370.483523

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCNC(=O)C2=C(N=CC=C2)SCC3=CC=CC=C3F

Isomeric SMILES

C1CCC(=CC1)CCNC(=O)C2=C(N=CC=C2)SCC3=CC=CC=C3F

InChI

InChI=1S/C21H23FN2OS/c22-19-11-5-4-9-17(19)15-26-21-18(10-6-13-24-21)20(25)23-14-12-16-7-2-1-3-8-16/h4-7,9-11,13H,1-3,8,12,14-15H2,(H,23,25)