5-(3,4-dihydro-2H-thiochromen-3-ylmethyl)-1H-imidazole

Systemtic Name: 5-(3,4-dihydro-2H-thiochromen-3-ylmethyl)-1H-imidazole Openeye Name: 5-(thiochroman-3-ylmethyl)-1H-imidazole CAS Name: 5-(3,4-dihydro-2H-1-benzothiopyran-3-ylmethyl)-1H-imidazole IUPAC Name: 5-(3,4-dihydro-2H-thiochromen-3-ylmethyl)-1H-imidazole Traditional Name: 5-(thiochroman-3-ylmethyl)-1H-imidazole Formula: C13H14N2S MolecularWeight: 230.32866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(CSC2=CC=CC=C21)CC3=CN=CN3

Isomeric SMILES

C1C(CSC2=CC=CC=C21)CC3=CN=CN3

InChI

InChI=1S/C13H14N2S/c1-2-4-13-11(3-1)5-10(8-16-13)6-12-7-14-9-15-12/h1-4,7,9-10H,5-6,8H2,(H,14,15)