4-[[4-cyclopropyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 4-[[4-cyclopropyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 4-[[4-cyclopropyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile CAS Name: 4-[[[4-cyclopropyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]thio]methyl]benzonitrile IUPAC Name: 4-[[4-cyclopropyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile Traditional Name: 4-[[[4-cyclopropyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]thio]methyl]benzonitrile Formula: C19H15FN4S MolecularWeight: 350.412603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCC3=CC=C(C=C3)C#N)C4=CC=CC=C4F

Isomeric SMILES

C1CC1N2C(=NN=C2SCC3=CC=C(C=C3)C#N)C4=CC=CC=C4F

InChI

InChI=1S/C19H15FN4S/c20-17-4-2-1-3-16(17)18-22-23-19(24(18)15-9-10-15)25-12-14-7-5-13(11-21)6-8-14/h1-8,15H,9-10,12H2