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

Systemtic Name: (2R)-2-[[4-methyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanenitrile Openeye Name: (2R)-2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanenitrile CAS Name: (2R)-2-[[4-methyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]propanenitrile IUPAC Name: (2R)-2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanenitrile Traditional Name: (2R)-2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)thio]propionitrile Formula: C13H14N4S MolecularWeight: 258.34206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)SC1=NN=C(N1C)CC2=CC=CC=C2

Isomeric SMILES

C[C@H](C#N)SC1=NN=C(N1C)CC2=CC=CC=C2

InChI

InChI=1S/C13H14N4S/c1-10(9-14)18-13-16-15-12(17(13)2)8-11-6-4-3-5-7-11/h3-7,10H,8H2,1-2H3/t10-/m1/s1