(2R)-2-[[4-phenyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanenitrile

Systemtic Name: (2R)-2-[[4-phenyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanenitrile Openeye Name: (2R)-2-[[4-phenyl-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanenitrile CAS Name: (2R)-2-[[4-phenyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]propanenitrile IUPAC Name: (2R)-2-[[4-phenyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanenitrile Traditional Name: (2R)-2-[[4-phenyl-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]propionitrile Formula: C16H14N4S2 MolecularWeight: 326.43916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)SC1=NN=C(N1C2=CC=CC=C2)CC3=CC=CS3

Isomeric SMILES

C[C@H](C#N)SC1=NN=C(N1C2=CC=CC=C2)CC3=CC=CS3

InChI

InChI=1S/C16H14N4S2/c1-12(11-17)22-16-19-18-15(10-14-8-5-9-21-14)20(16)13-6-3-2-4-7-13/h2-9,12H,10H2,1H3/t12-/m1/s1