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

Systemtic Name: (2R)-3-phenyl-2-[[4-(phenylmethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]propanenitrile Openeye Name: (2R)-2-[[4-benzyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-3-phenyl-propanenitrile CAS Name: (2R)-3-phenyl-2-[[4-(phenylmethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]propanenitrile IUPAC Name: (2R)-2-[(4-benzyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-3-phenylpropanenitrile Traditional Name: (2R)-2-[[4-benzyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-3-phenyl-propionitrile Formula: C22H18N4S2 MolecularWeight: 402.53512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C#N)SC2=NN=C(N2CC3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)C[C@H](C#N)SC2=NN=C(N2CC3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C22H18N4S2/c23-15-19(14-17-8-3-1-4-9-17)28-22-25-24-21(20-12-7-13-27-20)26(22)16-18-10-5-2-6-11-18/h1-13,19H,14,16H2/t19-/m1/s1