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

Systemtic Name: 3-ethyl-4-[[4-[(4-fluorophenyl)methoxy]-3-methoxy-phenyl]methylamino]-1H-1,2,4-triazole-5-thione Openeye Name: 3-ethyl-4-[[4-[(4-fluorophenyl)methoxy]-3-methoxy-phenyl]methylamino]-1H-1,2,4-triazole-5-thione CAS Name: 3-ethyl-4-[[4-[(4-fluorophenyl)methoxy]-3-methoxyphenyl]methylamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-ethyl-4-[[4-[(4-fluorophenyl)methoxy]-3-methoxyphenyl]methylamino]-1H-1,2,4-triazole-5-thione Traditional Name: 3-ethyl-4-[[4-(4-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=CC(=C(C=C2)OCC3=CC=C(C=C3)F)OC

Isomeric SMILES

CCC1=NNC(=S)N1NCC2=CC(=C(C=C2)OCC3=CC=C(C=C3)F)OC

InChI

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