2-[(4-tert-butyl-1,3-thiazol-2-yl)sulfanyl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone

Systemtic Name: 2-[(4-tert-butyl-1,3-thiazol-2-yl)sulfanyl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone Openeye Name: 2-(4-tert-butylthiazol-2-yl)sulfanyl-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone CAS Name: 2-[(4-tert-butyl-2-thiazolyl)thio]-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone IUPAC Name: 2-[(4-tert-butyl-1,3-thiazol-2-yl)sulfanyl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone Traditional Name: 2-[(4-tert-butylthiazol-2-yl)thio]-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone Formula: C18H22N2OS2 MolecularWeight: 346.51008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)SCC(=O)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)SCC(=O)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C18H22N2OS2/c1-18(2,3)15-11-22-17(19-15)23-12-16(21)20-9-8-13-6-4-5-7-14(13)10-20/h4-7,11H,8-10,12H2,1-3H3