2-[[(3-fluoranyl-4-methoxy-phenyl)methyl-methyl-amino]methyl]-4-phenyl-1,2,4-triazole-3-thione

Systemtic Name: 2-[[(3-fluoranyl-4-methoxy-phenyl)methyl-methyl-amino]methyl]-4-phenyl-1,2,4-triazole-3-thione Openeye Name: 2-[[(3-fluoro-4-methoxy-phenyl)methyl-methyl-amino]methyl]-4-phenyl-1,2,4-triazole-3-thione CAS Name: 2-[[(3-fluoro-4-methoxyphenyl)methyl-methylamino]methyl]-4-phenyl-1,2,4-triazole-3-thione IUPAC Name: 2-[[(3-fluoro-4-methoxyphenyl)methyl-methylamino]methyl]-4-phenyl-1,2,4-triazole-3-thione Traditional Name: 2-[[(3-fluoro-4-methoxy-benzyl)-methyl-amino]methyl]-4-phenyl-1,2,4-triazole-3-thione Formula: C18H19FN4OS MolecularWeight: 358.433063

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)OC)F)CN2C(=S)N(C=N2)C3=CC=CC=C3

Isomeric SMILES

CN(CC1=CC(=C(C=C1)OC)F)CN2C(=S)N(C=N2)C3=CC=CC=C3

InChI

InChI=1S/C18H19FN4OS/c1-21(11-14-8-9-17(24-2)16(19)10-14)13-23-18(25)22(12-20-23)15-6-4-3-5-7-15/h3-10,12H,11,13H2,1-2H3