3-ethyl-4-[[2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methylamino]-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-ethyl-4-[[2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methylamino]-1H-1,2,4-triazole-5-thione Openeye Name: 3-ethyl-4-[[2-[(4-fluorophenyl)methoxy]-1-naphthyl]methylamino]-1H-1,2,4-triazole-5-thione CAS Name: 3-ethyl-4-[[2-[(4-fluorophenyl)methoxy]-1-naphthalenyl]methylamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-ethyl-4-[[2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methylamino]-1H-1,2,4-triazole-5-thione Traditional Name: 3-ethyl-4-[[2-(4-fluorobenzyl)oxy-1-naphthyl]methylamino]-1H-1,2,4-triazole-5-thione Formula: C22H21FN4OS MolecularWeight: 408.491743

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NNC(=S)N1NCC2=C(C=CC3=CC=CC=C32)OCC4=CC=C(C=C4)F

Isomeric SMILES

CCC1=NNC(=S)N1NCC2=C(C=CC3=CC=CC=C32)OCC4=CC=C(C=C4)F

InChI

InChI=1S/C22H21FN4OS/c1-2-21-25-26-22(29)27(21)24-13-19-18-6-4-3-5-16(18)9-12-20(19)28-14-15-7-10-17(23)11-8-15/h3-12,24H,2,13-14H2,1H3,(H,26,29)