5-[5-azanyl-1-(3,4-dimethylphenyl)pyrazol-4-yl]-1,3,4-oxadiazole-2-thiolate

Systemtic Name: 5-[5-azanyl-1-(3,4-dimethylphenyl)pyrazol-4-yl]-1,3,4-oxadiazole-2-thiolate Openeye Name: 5-[5-amino-1-(3,4-dimethylphenyl)pyrazol-4-yl]-1,3,4-oxadiazole-2-thiolate CAS Name: 5-[5-amino-1-(3,4-dimethylphenyl)-4-pyrazolyl]-1,3,4-oxadiazole-2-thiolate IUPAC Name: 5-[5-amino-1-(3,4-dimethylphenyl)pyrazol-4-yl]-1,3,4-oxadiazole-2-thiolate Traditional Name: 5-[5-amino-1-(3,4-dimethylphenyl)pyrazol-4-yl]-1,3,4-oxadiazole-2-thiolate Formula: C13H12N5OS- MolecularWeight: 286.33228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=C(C=N2)C3=NN=C(O3)[S-])N)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=C(C=N2)C3=NN=C(O3)[S-])N)C

InChI

InChI=1S/C13H13N5OS/c1-7-3-4-9(5-8(7)2)18-11(14)10(6-15-18)12-16-17-13(20)19-12/h3-6H,14H2,1-2H3,(H,17,20)/p-1