5-(3-cyclopentylpropanoylamino)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-methylpropyl)benzamide

Systemtic Name: 5-(3-cyclopentylpropanoylamino)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-methylpropyl)benzamide Openeye Name: 5-(3-cyclopentylpropanoylamino)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-isobutyl-benzamide CAS Name: 5-[(3-cyclopentyl-1-oxopropyl)amino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-methylpropyl)benzamide IUPAC Name: 5-(3-cyclopentylpropanoylamino)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-methylpropyl)benzamide Traditional Name: 5-(3-cyclopentylpropanoylamino)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-isobutyl-benzamide Formula: C28H37N3O2 MolecularWeight: 447.61228

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=C(C=CC(=C1)NC(=O)CCC2CCCC2)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC(C)CNC(=O)C1=C(C=CC(=C1)NC(=O)CCC2CCCC2)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C28H37N3O2/c1-20(2)18-29-28(33)25-17-24(30-27(32)14-11-21-7-3-4-8-21)12-13-26(25)31-16-15-22-9-5-6-10-23(22)19-31/h5-6,9-10,12-13,17,20-21H,3-4,7-8,11,14-16,18-19H2,1-2H3,(H,29,33)(H,30,32)