3-[[4-azanyl-5-(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]propanenitrile

Systemtic Name: 3-[[4-azanyl-5-(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]propanenitrile Openeye Name: 3-[[4-amino-5-(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]propanenitrile CAS Name: 3-[[4-amino-5-(4-fluorophenyl)-1,2,4-triazol-3-yl]thio]propanenitrile IUPAC Name: 3-[[4-amino-5-(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]propanenitrile Traditional Name: 3-[[4-amino-5-(4-fluorophenyl)-1,2,4-triazol-3-yl]thio]propionitrile Formula: C11H10FN5S MolecularWeight: 263.294003

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NN=C(N2N)SCCC#N)F

Isomeric SMILES

C1=CC(=CC=C1C2=NN=C(N2N)SCCC#N)F

InChI

InChI=1S/C11H10FN5S/c12-9-4-2-8(3-5-9)10-15-16-11(17(10)14)18-7-1-6-13/h2-5H,1,7,14H2