2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-5-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-5-(trifluoromethyl)benzenecarbonitrile Openeye Name: 2-(1-methyltetrazol-5-yl)sulfanyl-5-(trifluoromethyl)benzonitrile CAS Name: 2-[(1-methyl-5-tetrazolyl)thio]-5-(trifluoromethyl)benzonitrile IUPAC Name: 2-(1-methyltetrazol-5-yl)sulfanyl-5-(trifluoromethyl)benzonitrile Traditional Name: 2-[(1-methyltetrazol-5-yl)thio]-5-(trifluoromethyl)benzonitrile Formula: C10H6F3N5S MolecularWeight: 285.24835

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SC2=C(C=C(C=C2)C(F)(F)F)C#N

Isomeric SMILES

CN1C(=NN=N1)SC2=C(C=C(C=C2)C(F)(F)F)C#N

InChI

InChI=1S/C10H6F3N5S/c1-18-9(15-16-17-18)19-8-3-2-7(10(11,12)13)4-6(8)5-14/h2-4H,1H3