5-methyl-2-phenyl-4-[(1H-1,2,4-triazol-5-ylamino)methylidene]pyrazole-3-thione

Systemtic Name: 5-methyl-2-phenyl-4-[(1H-1,2,4-triazol-5-ylamino)methylidene]pyrazole-3-thione Openeye Name: 5-methyl-2-phenyl-4-[(1H-1,2,4-triazol-5-ylamino)methylene]pyrazole-3-thione CAS Name: 5-methyl-2-phenyl-4-[(1H-1,2,4-triazol-5-ylamino)methylidene]-3-pyrazolethione IUPAC Name: 5-methyl-2-phenyl-4-[(1H-1,2,4-triazol-5-ylamino)methylidene]pyrazole-3-thione Traditional Name: 5-methyl-2-phenyl-4-[(1H-1,2,4-triazol-5-ylamino)methylene]-2-pyrazoline-3-thione Formula: C13H12N6S MolecularWeight: 284.33958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=S)C1=CNC2=NC=NN2)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=S)C1=CNC2=NC=NN2)C3=CC=CC=C3

InChI

InChI=1S/C13H12N6S/c1-9-11(7-14-13-15-8-16-17-13)12(20)19(18-9)10-5-3-2-4-6-10/h2-8H,1H3,(H2,14,15,16,17)