N-[4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-1,3-thiazol-2-yl]-2-methyl-benzamide

Systemtic Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-1,3-thiazol-2-yl]-2-methyl-benzamide Openeye Name: N-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)thiazol-2-yl]-2-methyl-benzamide CAS Name: N-[4-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-2-thiazolyl]-2-methylbenzamide IUPAC Name: N-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-1,3-thiazol-2-yl]-2-methylbenzamide Traditional Name: N-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)thiazol-2-yl]-2-methyl-benzamide Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=NC(=CS2)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=NC(=CS2)C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C21H19N3O2S/c1-14-6-2-5-9-17(14)19(25)23-21-22-18(13-27-21)20(26)24-11-10-15-7-3-4-8-16(15)12-24/h2-9,13H,10-12H2,1H3,(H,22,23,25)