1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[2-[(4-methylsulfonylphenyl)amino]-1,3-thiazol-4-yl]ethanone

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[2-[(4-methylsulfonylphenyl)amino]-1,3-thiazol-4-yl]ethanone Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[2-(4-methylsulfonylanilino)thiazol-4-yl]ethanone CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[2-(4-methylsulfonylanilino)-4-thiazolyl]ethanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[2-(4-methylsulfonylanilino)-1,3-thiazol-4-yl]ethanone Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[2-(4-mesylanilino)thiazol-4-yl]ethanone Formula: C21H21N3O3S2 MolecularWeight: 427.53974

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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