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

Systemtic Name: N-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]benzenesulfonamide Openeye Name: N-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]thiazol-2-yl]benzenesulfonamide CAS Name: N-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-thiazolyl]benzenesulfonamide IUPAC Name: N-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-1,3-thiazol-2-yl]benzenesulfonamide Traditional Name: N-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]thiazol-2-yl]benzenesulfonamide Formula: C20H19N3O3S2 MolecularWeight: 413.51316

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19N3O3S2/c24-19(23-11-10-15-6-4-5-7-16(15)13-23)12-17-14-27-20(21-17)22-28(25,26)18-8-2-1-3-9-18/h1-9,14H,10-13H2,(H,21,22)