5-(1-benzofuran-2-yl)-4-phenyl-2-(piperidin-1-ylmethyl)-1,2,4-triazole-3-thione

Systemtic Name: 5-(1-benzofuran-2-yl)-4-phenyl-2-(piperidin-1-ylmethyl)-1,2,4-triazole-3-thione Openeye Name: 5-(benzofuran-2-yl)-4-phenyl-2-(1-piperidylmethyl)-1,2,4-triazole-3-thione CAS Name: 5-(2-benzofuranyl)-4-phenyl-2-(1-piperidinylmethyl)-1,2,4-triazole-3-thione IUPAC Name: 5-(1-benzofuran-2-yl)-4-phenyl-2-(piperidin-1-ylmethyl)-1,2,4-triazole-3-thione Traditional Name: 5-(benzofuran-2-yl)-4-phenyl-2-(piperidinomethyl)-1,2,4-triazole-3-thione Formula: C22H22N4OS MolecularWeight: 390.50128

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CN2C(=S)N(C(=N2)C3=CC4=CC=CC=C4O3)C5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)CN2C(=S)N(C(=N2)C3=CC4=CC=CC=C4O3)C5=CC=CC=C5

InChI

InChI=1S/C22H22N4OS/c28-22-25(16-24-13-7-2-8-14-24)23-21(26(22)18-10-3-1-4-11-18)20-15-17-9-5-6-12-19(17)27-20/h1,3-6,9-12,15H,2,7-8,13-14,16H2