N-(3-fluorophenyl)-2-[(1-phenyl-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)oxymethyl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-(3-fluorophenyl)-2-[(1-phenyl-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)oxymethyl]-1,3-thiazole-4-carboxamide Openeye Name: N-(3-fluorophenyl)-2-[(1-phenyl-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)oxymethyl]thiazole-4-carboxamide CAS Name: N-(3-fluorophenyl)-2-[[2-(1-oxopropyl)-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-4-thiazolecarboxamide IUPAC Name: N-(3-fluorophenyl)-2-[(1-phenyl-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)oxymethyl]-1,3-thiazole-4-carboxamide Traditional Name: N-(3-fluorophenyl)-2-[(1-phenyl-2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl)oxymethyl]thiazole-4-carboxamide Formula: C29H26FN3O3S MolecularWeight: 515.598443

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1C3=CC=CC=C3)C=C(C=C2)OCC4=NC(=CS4)C(=O)NC5=CC(=CC=C5)F

Isomeric SMILES

CCC(=O)N1CCC2=C(C1C3=CC=CC=C3)C=C(C=C2)OCC4=NC(=CS4)C(=O)NC5=CC(=CC=C5)F

InChI

InChI=1S/C29H26FN3O3S/c1-2-27(34)33-14-13-19-11-12-23(16-24(19)28(33)20-7-4-3-5-8-20)36-17-26-32-25(18-37-26)29(35)31-22-10-6-9-21(30)15-22/h3-12,15-16,18,28H,2,13-14,17H2,1H3,(H,31,35)