N-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]-4-fluoranyl-benzamide Openeye Name: N-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]thiazol-2-yl]-4-fluoro-benzamide CAS Name: N-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-thiazolyl]-4-fluorobenzamide IUPAC Name: N-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-1,3-thiazol-2-yl]-4-fluorobenzamide Traditional Name: N-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]thiazol-2-yl]-4-fluoro-benzamide Formula: C21H18FN3O2S MolecularWeight: 395.449923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)CC3=CSC(=N3)NC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)CC3=CSC(=N3)NC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H18FN3O2S/c22-17-7-5-15(6-8-17)20(27)24-21-23-18(13-28-21)11-19(26)25-10-9-14-3-1-2-4-16(14)12-25/h1-8,13H,9-12H2,(H,23,24,27)