1-[[2-(3-phenylpropyl)-1,3-dithian-2-yl]methyl]imidazole

Systemtic Name: 1-[[2-(3-phenylpropyl)-1,3-dithian-2-yl]methyl]imidazole Openeye Name: 1-[[2-(3-phenylpropyl)-1,3-dithian-2-yl]methyl]imidazole CAS Name: 1-[[2-(3-phenylpropyl)-1,3-dithian-2-yl]methyl]imidazole IUPAC Name: 1-[[2-(3-phenylpropyl)-1,3-dithian-2-yl]methyl]imidazole Traditional Name: 1-[[2-(3-phenylpropyl)-1,3-dithian-2-yl]methyl]imidazole Formula: C17H22N2S2 MolecularWeight: 318.49998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSC(SC1)(CCCC2=CC=CC=C2)CN3C=CN=C3

Isomeric SMILES

C1CSC(SC1)(CCCC2=CC=CC=C2)CN3C=CN=C3

InChI

InChI=1S/C17H22N2S2/c1-2-6-16(7-3-1)8-4-9-17(20-12-5-13-21-17)14-19-11-10-18-15-19/h1-3,6-7,10-11,15H,4-5,8-9,12-14H2