5-(4-tert-butylphenyl)-2-[(2,6-dimethylmorpholin-4-yl)methyl]-4-phenyl-1,2,4-triazole-3-thione

Systemtic Name: 5-(4-tert-butylphenyl)-2-[(2,6-dimethylmorpholin-4-yl)methyl]-4-phenyl-1,2,4-triazole-3-thione Openeye Name: 5-(4-tert-butylphenyl)-2-[(2,6-dimethylmorpholin-4-yl)methyl]-4-phenyl-1,2,4-triazole-3-thione CAS Name: 5-(4-tert-butylphenyl)-2-[(2,6-dimethyl-4-morpholinyl)methyl]-4-phenyl-1,2,4-triazole-3-thione IUPAC Name: 5-(4-tert-butylphenyl)-2-[(2,6-dimethylmorpholin-4-yl)methyl]-4-phenyl-1,2,4-triazole-3-thione Traditional Name: 5-(4-tert-butylphenyl)-2-[(2,6-dimethylmorpholino)methyl]-4-phenyl-1,2,4-triazole-3-thione Formula: C25H32N4OS MolecularWeight: 436.61278

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)CN2C(=S)N(C(=N2)C3=CC=C(C=C3)C(C)(C)C)C4=CC=CC=C4

Isomeric SMILES

CC1CN(CC(O1)C)CN2C(=S)N(C(=N2)C3=CC=C(C=C3)C(C)(C)C)C4=CC=CC=C4

InChI

InChI=1S/C25H32N4OS/c1-18-15-27(16-19(2)30-18)17-28-24(31)29(22-9-7-6-8-10-22)23(26-28)20-11-13-21(14-12-20)25(3,4)5/h6-14,18-19H,15-17H2,1-5H3