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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H37N3O2/c1-3-20(2)29-28(33)25-18-24(30-27(32)15-12-21-8-4-5-9-21)13-14-26(25)31-17-16-22-10-6-7-11-23(22)19-31/h6-7,10-11,13-14,18,20-21H,3-5,8-9,12,15-17,19H2,1-2H3,(H,29,33)(H,30,32)