2-[(4-fluorophenyl)methylsulfanyl]-N-[2-methyl-5-(methylcarbamoyl)phenyl]pyridine-3-carboxamide

Systemtic Name: 2-[(4-fluorophenyl)methylsulfanyl]-N-[2-methyl-5-(methylcarbamoyl)phenyl]pyridine-3-carboxamide Openeye Name: 2-[(4-fluorophenyl)methylsulfanyl]-N-[2-methyl-5-(methylcarbamoyl)phenyl]pyridine-3-carboxamide CAS Name: 2-[(4-fluorophenyl)methylthio]-N-[2-methyl-5-(methylcarbamoyl)phenyl]-3-pyridinecarboxamide IUPAC Name: 2-[(4-fluorophenyl)methylsulfanyl]-N-[2-methyl-5-(methylcarbamoyl)phenyl]pyridine-3-carboxamide Traditional Name: 2-[(4-fluorobenzyl)thio]-N-[2-methyl-5-(methylcarbamoyl)phenyl]nicotinamide Formula: C22H20FN3O2S MolecularWeight: 409.476503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC)NC(=O)C2=C(N=CC=C2)SCC3=CC=C(C=C3)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC)NC(=O)C2=C(N=CC=C2)SCC3=CC=C(C=C3)F

InChI

InChI=1S/C22H20FN3O2S/c1-14-5-8-16(20(27)24-2)12-19(14)26-21(28)18-4-3-11-25-22(18)29-13-15-6-9-17(23)10-7-15/h3-12H,13H2,1-2H3,(H,24,27)(H,26,28)