2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-4-(trifluoromethyl)pyrimidine

Systemtic Name: 2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-4-(trifluoromethyl)pyrimidine Openeye Name: 2-(1-phenyltetrazol-5-yl)sulfanyl-4-(trifluoromethyl)pyrimidine CAS Name: 2-[(1-phenyl-5-tetrazolyl)thio]-4-(trifluoromethyl)pyrimidine IUPAC Name: 2-(1-phenyltetrazol-5-yl)sulfanyl-4-(trifluoromethyl)pyrimidine Traditional Name: 2-[(1-phenyltetrazol-5-yl)thio]-4-(trifluoromethyl)pyrimidine Formula: C12H7F3N6S MolecularWeight: 324.28439

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)SC3=NC=CC(=N3)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)SC3=NC=CC(=N3)C(F)(F)F

InChI

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