4-[[5-(1-adamantyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 4-[[5-(1-adamantyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 4-[[5-(1-adamantyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzonitrile CAS Name: 4-[[[5-(1-adamantyl)-1,3,4-oxadiazol-2-yl]thio]methyl]benzonitrile IUPAC Name: 4-[[5-(1-adamantyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzonitrile Traditional Name: 4-[[[5-(1-adamantyl)-1,3,4-oxadiazol-2-yl]thio]methyl]benzonitrile Formula: C20H21N3OS MolecularWeight: 351.46524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=NN=C(O4)SCC5=CC=C(C=C5)C#N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=NN=C(O4)SCC5=CC=C(C=C5)C#N

InChI

InChI=1S/C20H21N3OS/c21-11-13-1-3-14(4-2-13)12-25-19-23-22-18(24-19)20-8-15-5-16(9-20)7-17(6-15)10-20/h1-4,15-17H,5-10,12H2