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

Systemtic Name: 2-[[(2S)-2-methylmorpholin-4-yl]methyl]-4-phenyl-5-pyridin-4-yl-1,2,4-triazole-3-thione Openeye Name: 2-[[(2S)-2-methylmorpholin-4-yl]methyl]-4-phenyl-5-(4-pyridyl)-1,2,4-triazole-3-thione CAS Name: 2-[[(2S)-2-methyl-4-morpholinyl]methyl]-4-phenyl-5-pyridin-4-yl-1,2,4-triazole-3-thione IUPAC Name: 2-[[(2S)-2-methylmorpholin-4-yl]methyl]-4-phenyl-5-pyridin-4-yl-1,2,4-triazole-3-thione Traditional Name: 2-[[(2S)-2-methylmorpholino]methyl]-4-phenyl-5-(4-pyridyl)-1,2,4-triazole-3-thione Formula: C19H21N5OS MolecularWeight: 367.46794

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N5OS/c1-15-13-22(11-12-25-15)14-23-19(26)24(17-5-3-2-4-6-17)18(21-23)16-7-9-20-10-8-16/h2-10,15H,11-14H2,1H3/t15-/m0/s1