6-(3,5-dimethylpyrazol-1-yl)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]pyridine-3-carboxamide

Systemtic Name: 6-(3,5-dimethylpyrazol-1-yl)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]pyridine-3-carboxamide Openeye Name: 6-(3,5-dimethylpyrazol-1-yl)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]pyridine-3-carboxamide CAS Name: 6-(3,5-dimethyl-1-pyrazolyl)-N-[2-[(2-fluorophenyl)methylthio]ethyl]-3-pyridinecarboxamide IUPAC Name: 6-(3,5-dimethylpyrazol-1-yl)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]pyridine-3-carboxamide Traditional Name: 6-(3,5-dimethylpyrazol-1-yl)-N-[2-[(2-fluorobenzyl)thio]ethyl]nicotinamide Formula: C20H21FN4OS MolecularWeight: 384.470343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NC=C(C=C2)C(=O)NCCSCC3=CC=CC=C3F)C

Isomeric SMILES

CC1=CC(=NN1C2=NC=C(C=C2)C(=O)NCCSCC3=CC=CC=C3F)C

InChI

InChI=1S/C20H21FN4OS/c1-14-11-15(2)25(24-14)19-8-7-16(12-23-19)20(26)22-9-10-27-13-17-5-3-4-6-18(17)21/h3-8,11-12H,9-10,13H2,1-2H3,(H,22,26)