2-(2,3-dihydro-1-benzofuran-5-yl)-4-methyl-N-[3-[(1-oxidanylidene-2H-isoquinolin-4-yl)methyl]phenyl]-1,3-thiazole-5-carboxamide

Systemtic Name: 2-(2,3-dihydro-1-benzofuran-5-yl)-4-methyl-N-[3-[(1-oxidanylidene-2H-isoquinolin-4-yl)methyl]phenyl]-1,3-thiazole-5-carboxamide Openeye Name: 2-(2,3-dihydrobenzofuran-5-yl)-4-methyl-N-[3-[(1-oxo-2H-isoquinolin-4-yl)methyl]phenyl]thiazole-5-carboxamide CAS Name: 2-(2,3-dihydrobenzofuran-5-yl)-4-methyl-N-[3-[(1-oxo-2H-isoquinolin-4-yl)methyl]phenyl]-5-thiazolecarboxamide IUPAC Name: 2-(2,3-dihydro-1-benzofuran-5-yl)-4-methyl-N-[3-[(1-oxo-2H-isoquinolin-4-yl)methyl]phenyl]-1,3-thiazole-5-carboxamide Traditional Name: 2-coumaran-5-yl-N-[3-[(1-keto-2H-isoquinolin-4-yl)methyl]phenyl]-4-methyl-thiazole-5-carboxamide Formula: C29H23N3O3S MolecularWeight: 493.57622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC3=C(C=C2)OCC3)C(=O)NC4=CC=CC(=C4)CC5=CNC(=O)C6=CC=CC=C65

Isomeric SMILES

CC1=C(SC(=N1)C2=CC3=C(C=C2)OCC3)C(=O)NC4=CC=CC(=C4)CC5=CNC(=O)C6=CC=CC=C65

InChI

InChI=1S/C29H23N3O3S/c1-17-26(36-29(31-17)20-9-10-25-19(15-20)11-12-35-25)28(34)32-22-6-4-5-18(14-22)13-21-16-30-27(33)24-8-3-2-7-23(21)24/h2-10,14-16H,11-13H2,1H3,(H,30,33)(H,32,34)