2-(morpholin-4-ylmethyl)-4-phenyl-5-[(2-prop-2-enylphenoxy)methyl]-1,2,4-triazole-3-thione

Systemtic Name: 2-(morpholin-4-ylmethyl)-4-phenyl-5-[(2-prop-2-enylphenoxy)methyl]-1,2,4-triazole-3-thione Openeye Name: 5-[(2-allylphenoxy)methyl]-2-(morpholinomethyl)-4-phenyl-1,2,4-triazole-3-thione CAS Name: 2-(4-morpholinylmethyl)-4-phenyl-5-[(2-prop-2-enylphenoxy)methyl]-1,2,4-triazole-3-thione IUPAC Name: 2-(morpholin-4-ylmethyl)-4-phenyl-5-[(2-prop-2-enylphenoxy)methyl]-1,2,4-triazole-3-thione Traditional Name: 5-[(2-allylphenoxy)methyl]-2-(morpholinomethyl)-4-phenyl-1,2,4-triazole-3-thione Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC=CC=C1OCC2=NN(C(=S)N2C3=CC=CC=C3)CN4CCOCC4

Isomeric SMILES

C=CCC1=CC=CC=C1OCC2=NN(C(=S)N2C3=CC=CC=C3)CN4CCOCC4

InChI

InChI=1S/C23H26N4O2S/c1-2-8-19-9-6-7-12-21(19)29-17-22-24-26(18-25-13-15-28-16-14-25)23(30)27(22)20-10-4-3-5-11-20/h2-7,9-12H,1,8,13-18H2