2-propylsulfanyl-4-[3-(trifluoromethyl)-2H-1,2,3-triazol-1-yl]benzenecarbonitrile

Systemtic Name: 2-propylsulfanyl-4-[3-(trifluoromethyl)-2H-1,2,3-triazol-1-yl]benzenecarbonitrile Openeye Name: 2-propylsulfanyl-4-[3-(trifluoromethyl)-2H-triazol-1-yl]benzonitrile CAS Name: 2-(propylthio)-4-[3-(trifluoromethyl)-2H-triazol-1-yl]benzonitrile IUPAC Name: 2-propylsulfanyl-4-[3-(trifluoromethyl)-2H-triazol-1-yl]benzonitrile Traditional Name: 2-(propylthio)-4-[3-(trifluoromethyl)-2H-triazol-1-yl]benzonitrile Formula: C13H13F3N4S MolecularWeight: 314.32933

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=C(C=CC(=C1)N2C=CN(N2)C(F)(F)F)C#N

Isomeric SMILES

CCCSC1=C(C=CC(=C1)N2C=CN(N2)C(F)(F)F)C#N

InChI

InChI=1S/C13H13F3N4S/c1-2-7-21-12-8-11(4-3-10(12)9-17)19-5-6-20(18-19)13(14,15)16/h3-6,8,18H,2,7H2,1H3