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

Systemtic Name: (2R)-2-[[4-(3-fluorophenyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanyl]propanenitrile Openeye Name: (2R)-2-[[4-(3-fluorophenyl)-5-morpholino-1,2,4-triazol-3-yl]sulfanyl]propanenitrile CAS Name: (2R)-2-[[4-(3-fluorophenyl)-5-(4-morpholinyl)-1,2,4-triazol-3-yl]thio]propanenitrile IUPAC Name: (2R)-2-[[4-(3-fluorophenyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanyl]propanenitrile Traditional Name: (2R)-2-[[4-(3-fluorophenyl)-5-morpholino-1,2,4-triazol-3-yl]thio]propionitrile Formula: C15H16FN5OS MolecularWeight: 333.383843

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)SC1=NN=C(N1C2=CC(=CC=C2)F)N3CCOCC3

Isomeric SMILES

C[C@H](C#N)SC1=NN=C(N1C2=CC(=CC=C2)F)N3CCOCC3

InChI

InChI=1S/C15H16FN5OS/c1-11(10-17)23-15-19-18-14(20-5-7-22-8-6-20)21(15)13-4-2-3-12(16)9-13/h2-4,9,11H,5-8H2,1H3/t11-/m1/s1