3-tert-butyl-4-[(Z)-(1-phenylpyrazol-4-yl)methylideneamino]-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-tert-butyl-4-[(Z)-(1-phenylpyrazol-4-yl)methylideneamino]-1H-1,2,4-triazole-5-thione Openeye Name: 3-tert-butyl-4-[(Z)-(1-phenylpyrazol-4-yl)methyleneamino]-1H-1,2,4-triazole-5-thione CAS Name: 3-tert-butyl-4-[(Z)-(1-phenyl-4-pyrazolyl)methylideneamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-tert-butyl-4-[(Z)-(1-phenylpyrazol-4-yl)methylideneamino]-1H-1,2,4-triazole-5-thione Traditional Name: 3-tert-butyl-4-[(Z)-(1-phenylpyrazol-4-yl)methyleneamino]-1H-1,2,4-triazole-5-thione Formula: C16H18N6S MolecularWeight: 326.41932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NNC(=S)N1N=CC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=NNC(=S)N1/N=C\C2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C16H18N6S/c1-16(2,3)14-19-20-15(23)22(14)18-10-12-9-17-21(11-12)13-7-5-4-6-8-13/h4-11H,1-3H3,(H,20,23)/b18-10-