5-[(3-bromophenyl)carbonylamino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(oxolan-2-ylmethyl)benzamide

Systemtic Name: 5-[(3-bromophenyl)carbonylamino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(oxolan-2-ylmethyl)benzamide Openeye Name: 5-[(3-bromobenzoyl)amino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(tetrahydrofuran-2-ylmethyl)benzamide CAS Name: 5-[[(3-bromophenyl)-oxomethyl]amino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-oxolanylmethyl)benzamide IUPAC Name: 5-[(3-bromobenzoyl)amino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(oxolan-2-ylmethyl)benzamide Traditional Name: 5-[(3-bromobenzoyl)amino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(tetrahydrofurfuryl)benzamide Formula: C28H28BrN3O3 MolecularWeight: 534.44422

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)C2=C(C=CC(=C2)NC(=O)C3=CC(=CC=C3)Br)N4CCC5=CC=CC=C5C4

Isomeric SMILES

C1CC(OC1)CNC(=O)C2=C(C=CC(=C2)NC(=O)C3=CC(=CC=C3)Br)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C28H28BrN3O3/c29-22-8-3-7-20(15-22)27(33)31-23-10-11-26(32-13-12-19-5-1-2-6-21(19)18-32)25(16-23)28(34)30-17-24-9-4-14-35-24/h1-3,5-8,10-11,15-16,24H,4,9,12-14,17-18H2,(H,30,34)(H,31,33)