N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2,6-dimethyl-quinoline-4-carboxamide

Systemtic Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2,6-dimethyl-quinoline-4-carboxamide Openeye Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2,6-dimethyl-quinoline-4-carboxamide CAS Name: N-[2-[(2-fluorophenyl)methylthio]ethyl]-2,6-dimethyl-4-quinolinecarboxamide IUPAC Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2,6-dimethylquinoline-4-carboxamide Traditional Name: N-[2-[(2-fluorobenzyl)thio]ethyl]-2,6-dimethyl-cinchoninamide Formula: C21H21FN2OS MolecularWeight: 368.467643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NCCSCC3=CC=CC=C3F)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NCCSCC3=CC=CC=C3F)C

InChI

InChI=1S/C21H21FN2OS/c1-14-7-8-20-17(11-14)18(12-15(2)24-20)21(25)23-9-10-26-13-16-5-3-4-6-19(16)22/h3-8,11-12H,9-10,13H2,1-2H3,(H,23,25)