5-(1-phenyl-2H-1,2,3,4-tetrazol-5-ylidene)-4-(trifluoromethyl)pyrimidine-2-thione

Systemtic Name: 5-(1-phenyl-2H-1,2,3,4-tetrazol-5-ylidene)-4-(trifluoromethyl)pyrimidine-2-thione Openeye Name: 5-(1-phenyl-2H-tetrazol-5-ylidene)-4-(trifluoromethyl)pyrimidine-2-thione CAS Name: 5-(1-phenyl-2H-tetrazol-5-ylidene)-4-(trifluoromethyl)-2-pyrimidinethione IUPAC Name: 5-(1-phenyl-2H-tetrazol-5-ylidene)-4-(trifluoromethyl)pyrimidine-2-thione Traditional Name: 5-(1-phenyl-2H-tetrazol-5-ylidene)-4-(trifluoromethyl)pyrimidine-2-thione Formula: C12H7F3N6S MolecularWeight: 324.28439

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C3C=NC(=S)N=C3C(F)(F)F)N=NN2

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C3C=NC(=S)N=C3C(F)(F)F)N=NN2

InChI

InChI=1S/C12H7F3N6S/c13-12(14,15)9-8(6-16-11(22)17-9)10-18-19-20-21(10)7-4-2-1-3-5-7/h1-6H,(H,18,20)