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

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[2-[(4-methylsulfonylphenyl)amino]-1,3-thiazol-4-yl]methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-[2-(4-methylsulfonylanilino)thiazol-4-yl]methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[2-(4-methylsulfonylanilino)-4-thiazolyl]methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-[2-(4-methylsulfonylanilino)-1,3-thiazol-4-yl]methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-[2-(4-mesylanilino)thiazol-4-yl]methanone Formula: C20H19N3O3S2 MolecularWeight: 413.51316

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19N3O3S2/c1-28(25,26)17-8-6-16(7-9-17)21-20-22-18(13-27-20)19(24)23-11-10-14-4-2-3-5-15(14)12-23/h2-9,13H,10-12H2,1H3,(H,21,22)