2-[[(2S)-2-methylmorpholin-4-yl]methyl]-4-phenyl-5-(phenylmethyl)-1,2,4-triazole-3-thione

Systemtic Name: 2-[[(2S)-2-methylmorpholin-4-yl]methyl]-4-phenyl-5-(phenylmethyl)-1,2,4-triazole-3-thione Openeye Name: 5-benzyl-2-[[(2S)-2-methylmorpholin-4-yl]methyl]-4-phenyl-1,2,4-triazole-3-thione CAS Name: 2-[[(2S)-2-methyl-4-morpholinyl]methyl]-4-phenyl-5-(phenylmethyl)-1,2,4-triazole-3-thione IUPAC Name: 5-benzyl-2-[[(2S)-2-methylmorpholin-4-yl]methyl]-4-phenyl-1,2,4-triazole-3-thione Traditional Name: 5-benzyl-2-[[(2S)-2-methylmorpholino]methyl]-4-phenyl-1,2,4-triazole-3-thione Formula: C21H24N4OS MolecularWeight: 380.50646

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCO1)CN2C(=S)N(C(=N2)CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C[C@H]1CN(CCO1)CN2C(=S)N(C(=N2)CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H24N4OS/c1-17-15-23(12-13-26-17)16-24-21(27)25(19-10-6-3-7-11-19)20(22-24)14-18-8-4-2-5-9-18/h2-11,17H,12-16H2,1H3/t17-/m0/s1