3-(1,3-dimethylpyrazol-4-yl)-4-(4-ethoxyphenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(1,3-dimethylpyrazol-4-yl)-4-(4-ethoxyphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-(1,3-dimethylpyrazol-4-yl)-4-(4-ethoxyphenyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-(1,3-dimethyl-4-pyrazolyl)-4-(4-ethoxyphenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(1,3-dimethylpyrazol-4-yl)-4-(4-ethoxyphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-(1,3-dimethylpyrazol-4-yl)-4-p-phenetyl-1H-1,2,4-triazole-5-thione Formula: C15H17N5OS MolecularWeight: 315.39338

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=NNC2=S)C3=CN(N=C3C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=NNC2=S)C3=CN(N=C3C)C

InChI

InChI=1S/C15H17N5OS/c1-4-21-12-7-5-11(6-8-12)20-14(16-17-15(20)22)13-9-19(3)18-10(13)2/h5-9H,4H2,1-3H3,(H,17,22)