5-[5-(3,4-diethoxyphenyl)-1,2-oxazol-3-yl]-1,2-dihydro-1,2,4-triazole-3-thione

Systemtic Name: 5-[5-(3,4-diethoxyphenyl)-1,2-oxazol-3-yl]-1,2-dihydro-1,2,4-triazole-3-thione Openeye Name: 5-[5-(3,4-diethoxyphenyl)isoxazol-3-yl]-1,2-dihydro-1,2,4-triazole-3-thione CAS Name: 5-[5-(3,4-diethoxyphenyl)-3-isoxazolyl]-1,2-dihydro-1,2,4-triazole-3-thione IUPAC Name: 5-[5-(3,4-diethoxyphenyl)-1,2-oxazol-3-yl]-1,2-dihydro-1,2,4-triazole-3-thione Traditional Name: 5-[5-(3,4-diethoxyphenyl)isoxazol-3-yl]-1,2-dihydro-1,2,4-triazole-3-thione Formula: C15H16N4O3S MolecularWeight: 332.37754

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=CC(=NO2)C3=NC(=S)NN3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=CC(=NO2)C3=NC(=S)NN3)OCC

InChI

InChI=1S/C15H16N4O3S/c1-3-20-11-6-5-9(7-13(11)21-4-2)12-8-10(19-22-12)14-16-15(23)18-17-14/h5-8H,3-4H2,1-2H3,(H2,16,17,18,23)