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

Systemtic Name: 3-ethyl-4-[[2-[(2-fluorophenyl)methoxy]-3-methoxy-phenyl]methylamino]-1H-1,2,4-triazole-5-thione Openeye Name: 3-ethyl-4-[[2-[(2-fluorophenyl)methoxy]-3-methoxy-phenyl]methylamino]-1H-1,2,4-triazole-5-thione CAS Name: 3-ethyl-4-[[2-[(2-fluorophenyl)methoxy]-3-methoxyphenyl]methylamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-ethyl-4-[[2-[(2-fluorophenyl)methoxy]-3-methoxyphenyl]methylamino]-1H-1,2,4-triazole-5-thione Traditional Name: 3-ethyl-4-[[2-(2-fluorobenzyl)oxy-3-methoxy-benzyl]amino]-1H-1,2,4-triazole-5-thione Formula: C19H21FN4O2S MolecularWeight: 388.459043

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NNC(=S)N1NCC2=C(C(=CC=C2)OC)OCC3=CC=CC=C3F

Isomeric SMILES

CCC1=NNC(=S)N1NCC2=C(C(=CC=C2)OC)OCC3=CC=CC=C3F

InChI

InChI=1S/C19H21FN4O2S/c1-3-17-22-23-19(27)24(17)21-11-13-8-6-10-16(25-2)18(13)26-12-14-7-4-5-9-15(14)20/h4-10,21H,3,11-12H2,1-2H3,(H,23,27)