3-[2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinolin-1-yl]-1,2,5-thiadiazole

Systemtic Name: 3-[2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinolin-1-yl]-1,2,5-thiadiazole Openeye Name: 3-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-1-yl]-1,2,5-thiadiazole CAS Name: 3-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-1-yl]-1,2,5-thiadiazole IUPAC Name: 3-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-1-yl]-1,2,5-thiadiazole Traditional Name: 3-(2-besyl-3,4-dihydro-1H-isoquinolin-1-yl)-1,2,5-thiadiazole Formula: C17H15N3O2S2 MolecularWeight: 357.4499

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C2=CC=CC=C21)C3=NSN=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(C(C2=CC=CC=C21)C3=NSN=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C17H15N3O2S2/c21-24(22,14-7-2-1-3-8-14)20-11-10-13-6-4-5-9-15(13)17(20)16-12-18-23-19-16/h1-9,12,17H,10-11H2