2-[(1-propyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]-5-(trifluoromethyl)aniline

Systemtic Name: 2-[(1-propyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]-5-(trifluoromethyl)aniline Openeye Name: 2-[(1-propyltetrazol-5-yl)methylsulfanyl]-5-(trifluoromethyl)aniline CAS Name: 2-[(1-propyl-5-tetrazolyl)methylthio]-5-(trifluoromethyl)aniline IUPAC Name: 2-[(1-propyltetrazol-5-yl)methylsulfanyl]-5-(trifluoromethyl)aniline Traditional Name: [2-[(1-propyltetrazol-5-yl)methylthio]-5-(trifluoromethyl)phenyl]amine Formula: C12H14F3N5S MolecularWeight: 317.33327

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=N1)CSC2=C(C=C(C=C2)C(F)(F)F)N

Isomeric SMILES

CCCN1C(=NN=N1)CSC2=C(C=C(C=C2)C(F)(F)F)N

InChI

InChI=1S/C12H14F3N5S/c1-2-5-20-11(17-18-19-20)7-21-10-4-3-8(6-9(10)16)12(13,14)15/h3-4,6H,2,5,7,16H2,1H3