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

Systemtic Name: N-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]thiazol-2-yl]-4-methyl-benzenesulfonamide CAS Name: N-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-thiazolyl]-4-methylbenzenesulfonamide IUPAC Name: N-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-1,3-thiazol-2-yl]-4-methylbenzenesulfonamide Traditional Name: N-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]thiazol-2-yl]-4-methyl-benzenesulfonamide Formula: C21H21N3O3S2 MolecularWeight: 427.53974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC(=CS2)CC(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC(=CS2)CC(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C21H21N3O3S2/c1-15-6-8-19(9-7-15)29(26,27)23-21-22-18(14-28-21)12-20(25)24-11-10-16-4-2-3-5-17(16)13-24/h2-9,14H,10-13H2,1H3,(H,22,23)